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1.
Mol Pharm ; 21(6): 2908-2921, 2024 Jun 03.
Artículo en Inglés | MEDLINE | ID: mdl-38743928

RESUMEN

The physical stability of amorphous solid dispersions (ASDs) is a major topic in the formulation research of oral dosage forms. To minimize the effort of investigating the long-term stability using cost- and time-consuming experiments, we developed a thermodynamic and kinetic modeling framework to predict and understand the crystallization kinetics of ASDs during long-term storage below the glass transition. Since crystallization of the active phrarmaceutical ingredients (APIs) in ASDs largely depends on the amount of water absorbed by the ASDs, water-sorption kinetics and API-crystallization kinetics were considered simultaneously. The developed modeling approach allows prediction of the time evolution of viscosity, supersaturation, and crystallinity as a function of drug load, relative humidity, and temperature. It was applied and evaluated against two-year-lasting crystallization experiments of ASDs containing nifedipine and copovidone or HPMCAS measured in part I of this work. We could show that the proposed modeling approach is able to describe the interplay between water sorption and API crystallization and to predict long-term stabilities of ASDs just based on short-term measurements. Most importantly, it enables explaining and understanding the reasons for different and sometimes even unexpected crystallization behaviors of ASDs.


Asunto(s)
Cristalización , Agua , Cristalización/métodos , Agua/química , Cinética , Estabilidad de Medicamentos , Nifedipino/química , Compuestos de Vinilo/química , Termodinámica , Pirrolidinas/química , Viscosidad , Química Farmacéutica/métodos , Humedad , Temperatura , Solubilidad , Metilcelulosa/química , Metilcelulosa/análogos & derivados
2.
Environ Sci Technol ; 58(13): 5987-5995, 2024 Apr 02.
Artículo en Inglés | MEDLINE | ID: mdl-38504492

RESUMEN

Sorption to activated carbon is a common approach to reducing environmental risks of waterborne perfluorooctanoic acid (PFOA), while effective and flexible approaches to PFOA sorption are needed. Variations in temperature or the use of electrokinetic phenomena (electroosmosis and electromigration) in the presence of external DC electric fields have been shown to alter the contaminant sorption of contaminants. Their role in PFOA sorption, however, remains unclear. Here, we investigated the joint effects of DC electric fields and the temperature on the sorption of PFOA on activated carbon. Temperature-dependent batch and column sorption experiments were performed in the presence and absence of DC fields, and the results were evaluated by using different kinetic sorption models. We found an emerging interplay of DC and temperature on PFOA sorption, which was linked via the liquid viscosity (η) of the electrolyte. For instance, the combined presence of a DC field and low temperature increased the PFOA loading up to 38% in 48 h relative to DC-free controls. We further developed a model that allowed us to predict temperature- and DC field strength-dependent electrokinetic benefits on the drivers of PFOA sorption kinetics (i.e., intraparticle diffusivity and the film mass transfer coefficient). Our insights may give rise to future DC- and temperature-driven applications for PFOA sorption, for instance, in response to fluctuating PFOA concentrations in contaminated water streams.


Asunto(s)
Fluorocarburos , Contaminantes Químicos del Agua , Temperatura , Carbón Orgánico , Adsorción , Fluorocarburos/análisis , Caprilatos , Cinética , Contaminantes Químicos del Agua/análisis
3.
Int J Mol Sci ; 25(14)2024 Jul 18.
Artículo en Inglés | MEDLINE | ID: mdl-39063114

RESUMEN

The aim of this study was to examine the use of zwitterionic microparticles as new and efficient macromolecular supports for the sorption of an antibiotic (doxycycline hydrochloride, DCH) from aqueous solution. The effect of relevant process parameters of sorption, like dosage of microparticles, pH value, contact time, the initial concentration of drug and temperature, was evaluated to obtain the optimal experimental conditions. The sorption kinetics were investigated using Lagergren, Ho, Elovich and Weber-Morris models, respectively. The sorption efficiency was characterized by applying the Langmuir, Freundlich and Dubinin-Radushkevich isotherm models. The calculated thermodynamic parameters (ΔH, ΔS and ΔG) show that the sorption of doxycycline hydrochloride onto zwitterionic microparticles is endothermic, spontaneous and favorable at higher temperatures. The maximum identified sorption capacity value is 157.860 mg/g at 308 K. The Higuchi, Korsmeyer-Peppas, Baker-Lonsdale and Kopcha models are used to describe the release studies. In vitro release studies show that the release mechanism of doxycycline hydrochloride from zwitterionic microparticles is predominantly anomalous or non-Fickian diffusion. This study could provide the opportunity to expand the use of these new zwitterionic structures in medicine and water purification.


Asunto(s)
Betaína , Doxiciclina , Doxiciclina/química , Betaína/química , Cinética , Adsorción , Termodinámica , Concentración de Iones de Hidrógeno , Antibacterianos/química , Liberación de Fármacos , Temperatura , Microesferas
4.
Bull Environ Contam Toxicol ; 113(1): 6, 2024 Jul 09.
Artículo en Inglés | MEDLINE | ID: mdl-38980453

RESUMEN

Pesticide transport in the environment is impacted by the kinetics of its adsorption onto soil. The adsorption kinetics of pyrimethanil was investigated in ten soil samples of varying physicochemical properties. The highest adsorption was in the soil having the maximum silt and CaCO3 contents, pH and electrical conductance but the lowest amorphous Fe oxides and CaCl2 extractable Mn. Pseudo-second order kinetics and intra-particle diffusion model best accounted the adsorption kinetics of pyrimethanil. The equilibrium adsorption estimated by pseudo-second order kinetics (q02) was significantly and positively correlated with CaCl2 extractable Cu content (r = 0.709) while rate coefficient (k02) had a negative correlation with crystalline iron oxides content (r = -0.675). The intra-particle diffusion coefficient (ki.d.) had inverse relationship with CaCl2 extractable Mn content in soils (r = -0.689). FTIR spectra showed a significant interaction of pyrimethanil with micronutrient cations. Adsorption kinetic parameters of pyrimethanil could be successfully predicted by soil properties. The findings may help to evolve fungicide management decisions.


Asunto(s)
Fungicidas Industriales , Pirimidinas , Contaminantes del Suelo , Suelo , Adsorción , Fungicidas Industriales/química , Fungicidas Industriales/análisis , Cinética , Contaminantes del Suelo/química , Contaminantes del Suelo/análisis , Suelo/química , Pirimidinas/química , Pirimidinas/análisis , Modelos Químicos
5.
J Environ Sci (China) ; 146: 264-271, 2024 Dec.
Artículo en Inglés | MEDLINE | ID: mdl-38969454

RESUMEN

Slow release of emerging contaminants limits their accessibility from soil to pore water, constraining the treatment efficiency of physio-chemical treatment sites. DC fields mobilize organic contaminants and influence their interactions with geo-matrices such as zeolites. Poor knowledge, however, exists on the joint application of heating and electrokinetic approaches on perfluorooctanoic acid (PFOA) transport in porous media. Here, we investigated electrokinetic PFOA transport in zeolite-filled percolation columns at varying temperatures. Variations of pseudo-second-order kinetic constants (kPSO) were correlated to the liquid viscosity variations (η) and elctroosmotic flow velocities (vEOF). Applying DC fields and elevated temperature significantly (>37%) decreased PFOA sorption to zeolite. A good correlation between η, vEOF, and kPSO was found and used to develop an approach interlinking the three parameters to predict the joint effects of DC fields and temperature on PFOA sorption kinetics. These findings may give rise to future applications for better tailoring PFOA transport in environmental biotechnology.


Asunto(s)
Caprilatos , Fluorocarburos , Zeolitas , Caprilatos/química , Fluorocarburos/química , Adsorción , Zeolitas/química , Cinética , Modelos Químicos
6.
Environ Res ; 225: 115615, 2023 05 15.
Artículo en Inglés | MEDLINE | ID: mdl-36871944

RESUMEN

Plastics in the environment undergo various aging effects. Due to the changes in physical and chemical properties, the sorption behavior of aged microplastics (MPs) for pollutants differs from that of pristine MPs. In this paper, the most common disposable polypropylene (PP) rice box was used as the source of MPs to study the sorption and desorption behavior of nonylphenol (NP) on pristine and naturally aged PPs in summer and winter. The results show that summer-aged PP has more obvious property changes than winter-aged PP. The equilibrium sorption amount of NP on PP is summer-aged PP (477.08 µg/g) > winter-aged PP (407.14 µg/g) > pristine PP (389.29 µg/g). The sorption mechanism includes the partition effect, van der Waals forces, hydrogen bonds and hydrophobic interaction, among which chemical sorption (hydrogen bonding) dominates the sorption; moreover, partition also plays an important role in this process. Aged MPs' more robust sorption capacity is attributed to the larger specific surface area, stronger polarity and more oxygen-containing functional groups on the surface that are conducive to forming hydrogen bonds with NP. Desorption of NP in the simulated intestinal fluid is significant owning to intestinal micelles' presence: summer-aged PP (300.52 µg/g) > winter-aged PP (291.08 µg/g) > pristine PP (287.12 µg/g). Hence, aged PP presents a more vital ecological risk.


Asunto(s)
Microplásticos , Contaminantes Químicos del Agua , Plásticos , Polipropilenos , Fenoles , Adsorción , Contaminantes Químicos del Agua/análisis
7.
Int J Mol Sci ; 24(7)2023 Mar 31.
Artículo en Inglés | MEDLINE | ID: mdl-37047521

RESUMEN

In January 2023, the derogation loophole was closed on "emergency authorisations" for the use of three out of five neonicotinoids in all EU states. In this study, we analysed the sorption/desorption behaviour and kinetic parameters of acetamiprid and thiacloprid, the two neonicotinoids that are still approved for use, either regularly or under emergency authorisations in the EU, and widely used worldwide. Sorption and desorption curves in four soils with different organic matter content were analysed using four kinetic models, namely, Lagergren's pseudo first-order model, two-site model (TSM), Weber-Morris intraparticle diffusion model and Elovich's model. Kinetic parameters were correlated to soil physico-chemical characteristics. To determine the mutual influence of soil characteristics and sorption/desorption parameters in the analysed soils, a factor analysis based on principal component analysis (PCA) was performed. Even though the two insecticides are very similar in size and chemical structure, the results showed different sorption/desorption kinetics. The model that best fits the experimental data was TSM. Thiacloprid showed a more rapid sorption compared to acetamiprid, and, in all soils, a higher proportion sorbed at equilibrium. Intra-particle diffusion seemed to be a relevant process in acetamiprid sorption, but not for thiacloprid. Desorption results showed that acetamiprid is more easily and more thoroughly desorbed than thiacloprid, in all soils. The kinetic behaviour differences stem from variations in molecular structure, causing disparate water solubility, lipophilicity, and acid-base properties.


Asunto(s)
Contaminantes del Suelo , Adsorción , Neonicotinoides , Suelo/química , Cinética
8.
Int J Mol Sci ; 24(15)2023 Aug 03.
Artículo en Inglés | MEDLINE | ID: mdl-37569760

RESUMEN

Here, we report a new version of the extended Rate Constants Distribution (RCD) model for metal ion sorption, which includes complex-formation equilibria. With the RCD-complex model, one can predict sorbent performance in the presence of complexing agents using data on metal ion sorption from ligand-free solutions and a set of coefficients for sorption rate constants of different ionic species. The RCD-complex model was applied to breakthrough curves of Cu(II) sorption from acetate and tartrate solutions on polyethyleneimine (PEI) monolith cryogel at different flow rates and ionic speciation. We have shown that, despite the lower stability of Cu(II)-acetate complex, at high flow rates, acetate has a more pronounced negative effect on sorption kinetics than tartrate. The RCD model was successfully used to predict the shape of the breakthrough curves at an arbitrary acetate concentration but failed to predict Cu(II) sorption from tartrate solutions in a broad range of ligand concentrations. Since a twofold increase in sorption capacity was observed at low tartrate concentrations, the latter fact was related to an alteration in the sorption mechanism of Cu(II)-ions, which depended on Cu(II) ionic speciation. The obtained results emphasize the importance of information about sorption kinetics of different ionic forms for the optimization of sorption filter performance in the presence of complexing agents.


Asunto(s)
Criogeles , Polietileneimina , Cinética , Tartratos , Concentración de Iones de Hidrógeno , Metales , Iones , Acetatos , Adsorción , Cobre , Soluciones
9.
J Environ Manage ; 348: 119205, 2023 Dec 15.
Artículo en Inglés | MEDLINE | ID: mdl-37832288

RESUMEN

Walnut shells and apricot pits were used to produce non-activated, air-activated and steam-activated biochar. The specific surface area decreased in the order steam-activated (500-727 m 2.g-1), air-activated (59-514 m2.g-1) and non-activated biochars (1.71-236 m2.g-1). The results indicated that water steam created a multi-layer block structure with a well-developed porous structure, especially at 900 °C, while activation with air resulted in a more fragmented structure with a higher amount of coarse pores, leading to lower specific surface values. Acetone sorption experiments were performed in order to determine the acetone sorption capacity and to evaluate the acetone sorption kinetics of the biochars, as well as to identify the possible mechanism of sorption. The maximum sorption capacity estimated from the adsorption isotherms up to a relative pressure of 0.95 ranged from 60.3 to 277.3 mg g-1, and was highest in the steam-activated biochar with the largest surface area. The acetone adsorption isotherms were fitted with different adsorption models, where the Fritz-Schlunder model showed the best fitting results. The adsorption kinetics was evaluated using two kinetics models - pseudo first order and pseudo second order. The results indicated that the biochars with a large surface area exhibited physical sorption through van der Waals forces as the dominant mechanism, while acetone sorption on samples with a smaller surface area can be attributed to a mixed dual sorption mechanism, which combines physical sorption and chemisorption on oxygen functional groups. The perfect reusability of the biochars was confirmed by four consecutive adsorption-desorption cycles.


Asunto(s)
Vapor , Contaminantes Químicos del Agua , Acetona , Carbón Orgánico/química , Agua , Adsorción , Contaminantes Químicos del Agua/química
10.
J Environ Sci Health B ; 58(9): 583-593, 2023.
Artículo en Inglés | MEDLINE | ID: mdl-37614009

RESUMEN

In this work, vermicompost was prepared with maize stover and cattle dung in ratios of 60:40 (VC1), 50:50 (VC2) and 40:60 (VC3), and the physicochemical properties of the vermicompost were related to the ratio of the raw materials used. The effect of the vermicomposts on the adsorption kinetics, adsorption isotherms and desorption of atrazine were investigated in unamended soil (S) and soil amended with 4% (w/w) of VC1(S-VC1), VC2(S-VC2) and VC3(S-VC3). The total organic carbon (TOC) content of VC1, VC2 and VC3 was 38.46, 37.33 and 34.47%, the HA content was 43.50, 42.22 and 39.28 g/kg, and the HA/FA ratios was 1.47, 0.44 and 0.83, respectively. The adsorption of atrazine on the soil, on the vermicompost and on soils amended with vermicompost followed a pseudo-second-order kinetic model. The Freundlich equation better fitted the adsorption isotherm of atrazine. The vermicomposts enhanced atrazine adsorption and decreased atrazine desorption. Correlation analysis showed that the TOC and HA were significantly positively correlated with Kf, which indicated that TOC and HA of the vermicomposts contributed significantly to the adsorption and desorption of atrazine. This study demonstrated that vermicomposts have great potential in the bioremediation of atrazine pollution and that their role is related to the raw materials used to prepare them.


Asunto(s)
Atrazina , Animales , Bovinos , Adsorción , Contaminación Ambiental , Heces , Suelo
11.
Angew Chem Int Ed Engl ; 62(11): e202217103, 2023 Mar 06.
Artículo en Inglés | MEDLINE | ID: mdl-36640156

RESUMEN

Atmospheric water harvesting represents a promising technique to address water stress. Advanced adsorbents have been rationally designed to achieve high water uptake, yet their water sorption kinetics and regeneration temperature greatly limit water production efficiency. Herein, we demonstrated that 2D covalent organic frameworks (COFs), featuring hydrophobic skeleton, proper hydrophilic site density, and 1D open channels significantly lowered the water diffusion and desorption energy barrier. DHTA-Pa COF showed a high water uptake of 0.48 g/g at 30 % R.H. with a remarkable adsorption rate of 0.72 L/Kg/h (298 K) and a desorption rate of 2.58 L/Kg/h (333 K). Moreover, more than 90 % adsorbed water could be released within 20 min at 313 K. This kinetic performance surpassed the reported porous materials and boosted the efficiency for multiple water extraction cycles. It may shed light on the material design strategy to achieve high daily water production with low-energy input.

12.
Environ Res ; 210: 112929, 2022 07.
Artículo en Inglés | MEDLINE | ID: mdl-35167852

RESUMEN

Developing green inexpensive and effective adsorbents is critically needed for elimination of antibiotics from contaminated water. The current study assessed the nanostructured activated biochar (nPPAB) derived from pomegranate peels (PP) as a promising sorbent for efficient removal of the antibiotic ciprofloxacin (CIP). The results affirm that the second order and Langmuir models fit well to adsorption kinetics and equilibrium data respectively. The nPPAB adsorption capacity of Langmuir (qmax) for CIP was 142.86 mg g-1 which is 26.85 times greater than that of bulk PP. Hydrogen bonding, π-π interaction, hydrophobic and electrostatic interactions are the dominant mechanisms of CIP adsorption by nPPAB. The efficiency of nPPAB for CIP removal from real wastewater using batch and packed-bed reactor were 89.94 and 84.74% respectively. This study clearly demonstrated the substantial capacity of nPPAB as an ecofriendly, feasible, and in-expensive adsorbent for successful elimination of CIP from wastewater.


Asunto(s)
Ciprofloxacina , Contaminantes Químicos del Agua , Adsorción , Antibacterianos/química , Carbón Orgánico , Ciprofloxacina/química , Concentración de Iones de Hidrógeno , Cinética , Aguas Residuales , Contaminantes Químicos del Agua/análisis
13.
Sensors (Basel) ; 22(21)2022 Nov 05.
Artículo en Inglés | MEDLINE | ID: mdl-36366226

RESUMEN

When developing methods for diagnosing pathologies and diseases in humans and animals using electronic noses, one of the important trends is the miniaturization of devices, while maintaining significant information for diagnostic purposes. A combination of several sorbents that have unique sorption features of volatile organic compounds (VOCs) on one transducer is a possible option for the miniaturization of sensors for gas analysis. This paper considers the principles of creating polycomposite coatings on the electrodes of piezoelectric quartz resonators, including the choice of sorbents for the formation of sensitive layers, determining the mass and geometry of the formation of sensitive layers in a polycomposite coating, as well as an algorithm for processing the output data of sensors to obtain maximum information about the qualitative and quantitative composition of the gas phase. A comparative analysis of the efficiency and kinetics of VOC vapor sorption by sensors with polycomposite coatings and a set of sensors with relevant single coatings has been carried out. Regression equations have been obtained to predict the molar-specific sensitivity of the microbalance of VOC vapors by a sensor with a polycomposite coating of three sorbents with an error of 5-15% based on the results of the microbalance of VOC vapors on single coatings. A method for creating "visual prints" of sensor signals with polycomposite coatings is shown, with results comparable to those from an array of sensors. The parameters Aij∑ are proposed for obtaining information on the qualitative composition of the gas phase when processing the output data of sensors with polycomposite coatings. A biochemical study of exhaled breath condensate (EBC) samples, a microbiological investigation of calf tracheal washes, and a clinical examination were conducted to assess the presence of bovine respiratory disease (BRD). An analysis of the gas phase over EBC samples with an array of sensors with polycomposite coatings was also carried out. The "visual prints" of the responses of sensors with polycomposite coatings and the results of the identification of VOCs in the gas phase over EBC samples were compared to the results of bacteriological studies of tracheal washes of the studied calves. A connection was found between the parameters Aij∑ of a group of sensors with polycomposite coatings and the biochemical parameters of biosamples. The adequacy of replacing an array of piezoelectric sensors with single coatings by the sensors with polycomposite coatings is shown.


Asunto(s)
Compuestos Orgánicos Volátiles , Humanos , Bovinos , Animales , Compuestos Orgánicos Volátiles/análisis , Nariz Electrónica , Gases , Cuarzo , Electrodos
14.
J Sci Food Agric ; 102(5): 2135-2143, 2022 Mar 30.
Artículo en Inglés | MEDLINE | ID: mdl-34601730

RESUMEN

BACKGROUND: Duckweed has been considered as an alternative future food material as a result of its high nutritional values, although it also has a high moisture content resulting in a short shelf life. Moisture sorption isotherms are used to design dehydration and storage conditions to prolong the shelf life food products. To date, information regarding the sorption isotherm of duckweed has not been reported. Scanning electron microscopy (SEM) is frequently used to study food microstructure. However, this technique has to be performed under high-vacuum conditions and takes a long time. In the present study, two-photon imaging microscopy was selected to investigate the microstructure of dried duckweed instead of SEM. RESULTS: Among five sorption isotherm models, the Peleg model gave the highest goodness of fit. The monolayer moisture content (M0 ) of duckweed was in the range 7.43-7.92% dry basis (d.b.) and 8.87-8.86% d.b. for the GAB and BET multilayer kinetic models, respectively. The moisture changing behavior at each relative humidity step could be described by two exponential and reaction order kinetics. A clear cell structure (hexagonal shape) and stomata, as well as structural images (both 2D and 3D), were obtained using the two-photon microscopy technique. CONCLUSION: The Peleg model best described the moisture sorption behaviors of dried duckweed and the shape of sorption isotherms were classified as type III isotherm. The M0 of dried duckweed ranged from 7.43 to 8.86% d.b. Two-photon microscopy was a potent tool for investigating the microstructure and composition of dried duckweed. © 2021 Society of Chemical Industry.


Asunto(s)
Antioxidantes , Araceae , Cinética , Vacio , Agua/química
15.
Environ Sci Technol ; 55(10): 6542-6560, 2021 05 18.
Artículo en Inglés | MEDLINE | ID: mdl-33914502

RESUMEN

Sorption-based atmospheric water harvesting (SAWH), which uses sorbents to capture water vapor from the air and low-grade energy to produce fresh liquid water, has been recognized as a promising strategy for decentralized water supply in arid areas. This review aims to summarize the latest progress in this field and provide perspectives for the further development of SAWH, focusing on the design of sorbent materials and the optimization of the entire system. We first introduce the water sorption mechanisms on different sorbent materials. Next, we discuss the properties and performances of various sorbents developed for SAWH by categorizing them into specific groups: nanoporous solids, hygroscopic polymers, salt-based composites, and liquid sorbents; for each type of sorbent materials, we have analyzed its advantages and limitations, as well as design strategies. In addition, we discuss the influences of the mass and heat transport of the SAWH system on its overall performance in actual operations, and introduce different types of water harvesters developed for SAWH. In the last section, we outline the challenges in this field from fundamental research and practical application aspects, and describe roadmaps for the future development of this technology.


Asunto(s)
Contaminantes Químicos del Agua , Purificación del Agua , Adsorción , Agua , Abastecimiento de Agua
16.
Molecules ; 26(23)2021 Dec 02.
Artículo en Inglés | MEDLINE | ID: mdl-34885904

RESUMEN

The transport of carbamazepine, ciprofloxacin and sulfamethoxazole in the different pores of activated carbon in an aqueous solution is a dynamic process that is entirely dependent on the intrinsic parameters of these molecules and of the adsorbent. The macroscopic processes that take place are analyzed by interfacial diffusion and reaction models. Modeling of the experimental kinetic curves obtained following batch treatment of each solute at 2 µg/L in tap water showed (i) that the transport and sorption rates were controlled by external diffusion and intraparticle diffusion and (ii) that the effective diffusion coefficient for each solute, with the surface and pore diffusion coefficients, were linked by a linear relationship. A statistical analysis of the experimental data established correlations between the diffusional parameters and some geometrical parameters of these three molecules. Given the major discontinuities observed in the adsorption kinetics, the modeling of the experimental data required the use of traditional kinetic models, as well as a new kinetic model composed of the pseudo first or second order model and a sigmoidal expression. The predictions of this model were excellent. The solubility of each molecule below 60 °C was formulated by an empirical expression.


Asunto(s)
Carbamazepina/análisis , Carbón Orgánico/química , Ciprofloxacina/análisis , Sulfametoxazol/análisis , Contaminantes Químicos del Agua/análisis , Adsorción , Carbamazepina/aislamiento & purificación , Ciprofloxacina/aislamiento & purificación , Difusión , Porosidad , Solubilidad , Sulfametoxazol/aislamiento & purificación , Contaminantes Químicos del Agua/aislamiento & purificación , Purificación del Agua
17.
Molecules ; 25(20)2020 Oct 19.
Artículo en Inglés | MEDLINE | ID: mdl-33086660

RESUMEN

Here we report the method of fabrication of supermacroporous monolith sorbents (cryogels) via covalent cross-linking of polyallylamine (PAA) with diglycidyl ether of 1,4-butandiol. Using comparative analysis of the permeability and sorption performance of the obtained PAA cryogels and earlier developed polyethyleneimine (PEI) cryogels, we have demonstrated the advantages and disadvantages of these polymers as sorbents of heavy metal ions (Cu(II), Zn(II), Cd(II), and Ni(II)) in fixed-bed applications and as supermacroporous matrices for the fabrication of composite cryogels containing copper ferrocyanide (CuFCN) for cesium ion sorption. Applying the rate constant distribution (RCD) model to the kinetic curves of Cu(II) ion sorption on PAA and PEI cryogels, we have elucidated the difference in sorption/desorption rates and affinity constants of these materials and showed that physical sorption contributed to the Cu(II) uptake by PAA, but not to that by PEI cryogels. It was shown that PAA cryogels had significantly higher selectivity for Cu(II) sorption in the presence of Zn(II) and Cd(II) ions in comparison with that of PEI cryogels, while irreversible sorption of Co(II) ions by PEI can be used for the separation of Ni(II) and Co(II) ions. Using IR and Mössbauer spectroscopy, we have demonstrated that strong complexation of Cu(II) ions with PEI significantly affects the in situ formation of Cu(II) ferrocyanide nanosorbents leading to their inefficiency for Cs+ ions selective uptake, whereas PAA cryogel was applicable for the fabrication of efficient monolith composites via the in situ formation of CuFCN or loading of ex situ formed CuFCN colloids.


Asunto(s)
Adsorción/efectos de los fármacos , Quelantes/química , Criogeles/química , Metales Pesados/aislamiento & purificación , Concentración de Iones de Hidrógeno , Iones/química , Iones/aislamiento & purificación , Metales Pesados/química , Poliaminas/química , Polihidroxietil Metacrilato/química , Desintoxicación por Sorción
18.
Molecules ; 25(5)2020 Mar 10.
Artículo en Inglés | MEDLINE | ID: mdl-32164286

RESUMEN

Removal of Cr(VI) from the environment represents a stringent issue because of its tremendous effects on living organisms. In this context, design of sorbents with high sorption capacity for Cr(VI) is getting a strong need. For this purpose, poly(vinylbenzyl chloride), impregnated into porous silica (PSi), was cross-linked with either N,N,N',N'-tetramethyl-1,2-ethylenediamine (TEMED) or N,N,N',N'-tetramethyl-1,3-propanediamine, followed by the reaction of the free -CH2Cl groups with N,N-diethyl-2-hydroxyethylamine to generate strong base anion exchangers (ANEX) inside the pores. The PSi/ANEX composite sorbents were deeply characterized by FTIR spectroscopy, SEM-energy dispersive X-ray spectroscopy (EDX), thermogravimetric analysis (TGA), and water uptake. The sorption performances of composites against Cr(VI) were investigated as a function of pH, contact time, initial concentration of Cr(VI), and temperature. It was found that the cross-linker structure and the silica morphology are the key factors controlling the sorption capacity. The adsorption process was spontaneous and endothermic and well described by pseudo-second-order kinetic and Sips isotherm models. The maximum sorption capacity of 311.2 mg Cr(VI)/g sorbent was found for the composite prepared with mesoporous silica using TEMED as cross-linker. The PSi/ANEX composite sorbents represent an excellent alternative for the removal of Cr(VI) oxyanions, being endowed with fast kinetics, equilibrium in about 60 min, and a high level of reusability in successive sorption/desorption cycles.


Asunto(s)
Aniones/química , Cromo/química , Dióxido de Silicio/química , Adsorción , Concentración de Iones de Hidrógeno , Cinética , Temperatura , Agua/química , Contaminantes Químicos del Agua/química , Purificación del Agua/métodos
19.
J Environ Sci Health B ; 55(12): 1021-1031, 2020.
Artículo en Inglés | MEDLINE | ID: mdl-32941097

RESUMEN

Sorption to roots is one of several mechanisms by which plant-assisted attenuation of antibiotics can be achieved. The objectives of this study were to (1) evaluate the sorption of sulfamethoxazole (SMX) by cattail and switchgrass roots, (2) determine the kinetics of SMX sorption by cattail and switchgrass roots, and (3) characterize the temperature-dependency of SMX sorption. A batch sorption experiment was conducted to measure SMX sorption by roots of the two plant species using five initial antibiotic concentrations (2.5, 5, 10, 15, and 20 µg L-1) and eight sampling times (0, 0.5, 1, 2, 4, 8, 12, and 24 h). Another batch experiment was conducted at three temperatures (5, 15, and 25 °C) to determine the effect of temperature on sorption kinetics. SMX sorption followed pseudo-second-order kinetics. The pseudo-second-order rate constant (k2) decreased with increasing temperature for both plant species. The rate constant followed the order: 5 °C = 15 °C > 25 °C for cattail and 5 °C > 15 °C = 25 °C for switchgrass. Results from this study show that switchgrass roots are more effective than cattail roots in the removal of SMX. Therefore, the use of switchgrass in systems designed for phytoremediation of contaminants might also provide an efficient removal of some antibiotics.


Asunto(s)
Antibacterianos/farmacocinética , Panicum/metabolismo , Sulfametoxazol/farmacocinética , Typhaceae/metabolismo , Adsorción , Biodegradación Ambiental , Panicum/efectos de los fármacos , Raíces de Plantas/efectos de los fármacos , Raíces de Plantas/metabolismo , Contaminantes del Suelo/farmacocinética , Especificidad de la Especie , Temperatura , Typhaceae/efectos de los fármacos
20.
Bull Environ Contam Toxicol ; 104(4): 503-510, 2020 Apr.
Artículo en Inglés | MEDLINE | ID: mdl-32064538

RESUMEN

Kresoxim methyl sorption in soils of five agro-climatic zones of India varied from 41.6% to 84.7%. Highest sorption was recorded in organic carbon rich Almora soil. Isotherm parameters for linear and non-linear Freundlich and Temkin models were almost same, whereas Langmuir parameter Q0, for linear (1.60 to 9.434 µg g-1) and non-linear (8.48 to 17.129 µg g-1) models were quite different. For isotherms optimization different error functions such as sum of squares error (SSE), root mean square error (RMSE), Chi square error, hybrid fractional error (HYBRID) and average relative error (ARE) were calculated. Lowest error function values were obtained for Freundlich isotherm in all the soils except inceptisol (Kolkata) for which Langmuir isotherm gave the best fit. Statistical analysis using SAS 9.3 software and Tukey's HSD test revealed the significant effect (p < 0.001) of soil type on sorption. Sorption correlated positively with the organic carbon and clay contents of the soil.


Asunto(s)
Monitoreo del Ambiente/métodos , Modelos Teóricos , Contaminantes del Suelo/análisis , Suelo/química , Estrobilurinas/análisis , Adsorción , Agricultura , India , Modelos Lineales , Dinámicas no Lineales
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