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1.
Environ Sci Technol ; 58(17): 7628-7635, 2024 Apr 30.
Artigo em Inglês | MEDLINE | ID: mdl-38646668

RESUMO

Partitioning from water to nonaqueous phases is an important process that controls the behavior of contaminants in the environment and biota. However, for ionic chemicals including many perfluoroalkyl and polyfluoroalkyl substances (PFAS), environmentally relevant partition coefficients cannot be predicted using the octanol/water partition coefficient, which is commonly used as a hydrophobicity indicator for neutral compounds. As an alternative, this study measured C18 liquid chromatography retention times of 39 anionic PFAS and 20 nonfluorinated surfactants using isocratic methanol/water eluent systems. By measuring a series of PFAS with different perfluoroalkyl chain lengths, retention factors at 100% water (k0) were successfully extrapolated even for long-chain PFAS. Molecular size was the most important factor determining the k0 of PFAS and non-PFAS, suggesting that the cavity formation process is the key driver for retention. Log k0 showed a high correlation with the log of partition coefficients from water to the phospholipid membrane, air/water interface, and soil organic carbon. The results indicate the potential of C18 retention factors as predictive descriptors for anionic PFAS partition coefficients and the possibility of developing a more comprehensive multiparameter model for the partitioning of anionic substances in general.


Assuntos
Interações Hidrofóbicas e Hidrofílicas , Ânions/química , Adsorção , Fluorocarbonos/química , Tensoativos/química , Água/química , Cromatografia Líquida
2.
Environ Sci Technol ; 57(22): 8406-8413, 2023 06 06.
Artigo em Inglês | MEDLINE | ID: mdl-37232091

RESUMO

Per- and polyfluoroalkyl substances (PFAS) are a group of chemicals of high environmental concern. However, reliable data for the air/water partition coefficients (Kaw), which are required for fate, exposure, and risk analysis, are available for only a few PFAS. In this study, Kaw values at 25 °C were determined for 21 neutral PFAS by using the hexadecane/air/water thermodynamic cycle. Hexadecane/water partition coefficients (KHxd/w) were measured with batch partition, shared-headspace, and/or modified variable phase ratio headspace methods and were divided by hexadecane/air partition coefficients (KHxd/air) to obtain Kaw values over 7 orders of magnitude (10-4.9 to 102.3). Comparison to predicted Kaw values by four models showed that the quantum chemically based COSMOtherm model stood out for accuracy with a root-mean-squared error (RMSE) of 0.42 log units, as compared to HenryWin, OPERA, and the linear solvation energy relationship with predicted descriptors (RMSE, 1.28-2.23). The results indicate the advantage of a theoretical model over empirical models for a data-poor class like PFAS and the importance of experimentally filling data gaps in the chemical domain of environmental interest. Kaw values for 222 neutral (or neutral species of) PFAS were predicted using COSMOtherm as current best estimates for practical and regulatory use.


Assuntos
Fluorocarbonos , Água , Água/química , Ar/análise , Alcanos , Fluorocarbonos/análise
3.
Environ Health Prev Med ; 26(1): 92, 2021 Sep 18.
Artigo em Inglês | MEDLINE | ID: mdl-34536991

RESUMO

BACKGROUND: Particulate matter (PM) is recognized as the most harmful air pollutant to the human health. The Yangon city indeed suffers much from PM-related air pollution. Recent research has interestingly been focused on the novel subject of changes in the air quality associated with the restrictive measures in place during the current coronavirus disease-2019 (COVID-19) pandemic. The first case of COVID-19 in Myanmar was diagnosed on March 23, 2020. In this article, we report on our attempt to evaluate any effects of the COVID-19-restrictive measures on the ambient PM pollution in Yangon. METHODS: We measured the PM concentrations every second for 1 week on four occasions at three study sites with different characteristics; the first occasion was before the start of the COVID-19 pandemic and the remaining three occasions were while the COVID-19-restrictive measures were in place, including Stay-At-Home and Work-From-Home orders. The Pocket PM2.5 Sensor [PRO] designed by the National Institute for Environmental Studies (NIES), Japan, in cooperation with Yaguchi Electric Co., Ltd., (Miyagi, Japan) was used for the measurement of the ambient PM2.5 and PM10 concentrations. RESULTS: The results showed that there was a significant reduction (P < 0.001) in both the PM2.5 and PM10 concentrations while the COVID-19-restrictive measures were in place as compared to the measured values prior to the pandemic. The city experienced a profound improvement in the PM-related air quality from the "unhealthy" category prior to the onset of the COVID-19 pandemic to the "good" category during the pandemic, when the restrictive measures were in place. The percent changes in the PM concentrations varied among the three study sites, with the highest percent reduction noted in a semi-commercial crowded area (84.8% for PM2.5; 88.6% for PM10) and the lowest percent reduction noted in a residential quiet area (15.6% for PM2.5; 12.0% for PM10); the percent reductions also varied among the different occasions during the COVID-19 pandemic that the measurements were made. CONCLUSIONS: We concluded that the restrictive measures which were in effect to combat the COVID-19 pandemic had a positive impact on the ambient PM concentrations. The changes in the PM concentrations are considered to be largely attributable to reduction in anthropogenic emissions as a result of the restrictive measures, although seasonal influences could also have contributed in part. Thus, frequent, once- or twice-weekly Stay-At-Home or Telework campaigns, may be feasible measures to reduce PM-related air pollution. When devising such an action plan, it would be essential to raise the awareness of public about the health risks associated with air pollution and create a social environment in which Telework can be carried out, in order to ensure active compliance by the citizens.


Assuntos
Poluição do Ar/análise , COVID-19/epidemiologia , Material Particulado/análise , Humanos , Mianmar/epidemiologia , Pandemias , SARS-CoV-2
4.
Chemosphere ; 46(1): 39-47, 2002 Jan.
Artigo em Inglês | MEDLINE | ID: mdl-11806531

RESUMO

A laboratory-scale ultrasonication technique was developed for fluoranthene extraction from soils and sediments where the utilized organic solvent would be recovered after the extraction process. Therefore, the remedied soils and sediments would be free from toxicant and trace of added chemicals. The developed ultrasonication technique outlined here is an integrated part of a complete remediation system consisting of extraction and solar detoxification reactors. This paper investigates extraction efficiencies under different conditions, outlines solvent recovery technique and compares extraction efficiency of the developed ultrasonication technique with a commercially available laboratory-scale sonication bath. The spiked soil sample with fluoranthene (19.4 microg g(-1)) and organic solvent was ultrasonicated at 40 degrees C for 20 min. The sonicated mixture was allowed to settle for 10 min before the extract gravitated into the modified solar reactor for fluoranthene detoxification. The added solvents were removed from the remedied soil before it was released to site. The mixture of cyclohexane and ethanol (CH:ETOH) (3:1) was the favorable solvent from among 10 organic solvents because of its high extraction efficiency, safety and low cost. Preliminary results indicated that the developed extraction technique recovered more than 93% of fluoranthene from soil samples.


Assuntos
Fluorenos/isolamento & purificação , Sedimentos Geológicos/análise , Hidrocarbonetos Policíclicos Aromáticos/isolamento & purificação , Poluentes do Solo/isolamento & purificação , Solo/análise , Sonicação/instrumentação , Reatores Biológicos , Cicloexanos/administração & dosagem , Etanol/administração & dosagem , Fluorenos/química , Sedimentos Geológicos/química , Compostos Orgânicos , Hidrocarbonetos Policíclicos Aromáticos/química , Tamanho da Amostra , Solventes , Temperatura
5.
Chemosphere ; 46(1): 49-57, 2002 Jan.
Artigo em Inglês | MEDLINE | ID: mdl-11806532

RESUMO

A laboratory-scale solar reactor and photodegradation technique were developed to enhance the degradation process of fluoranthene. Fluoranthene was used in this study to represent toxic polycyclic aromatic hydrocarbons (PAHs) that are persistent in the environment. The extracted fluoranthene from soil in organic solvent (EFOS) and hydrogen peroxide (H2O2) were pumped from a 100 ml vessel into a solar glass cell coated with titanium dioxide (TiO2) at 80 microl min(-1). This work compares the efficiency of the developed photocatalytic degradation technique with the conventional batch process. The degradation efficiency of the developed technique was assessed at different initial concentrations of fluoranthene and percentages of H2O2 in the extract using different flow rates. Preliminary results indicated that the developed technique degraded 99% of fluoranthene from EFOS in the presence of H2O2 and 83% without H2O2. There was no significant difference between fluoranthene degradation rates by the developed technique and the batch method. The developed technique however, treated double the volume of solution that was treated by the batch reactor method which was time consuming and required continuous attention.


Assuntos
Fluorenos/isolamento & purificação , Sedimentos Geológicos/análise , Hidrocarbonetos Policíclicos Aromáticos/isolamento & purificação , Poluentes do Solo/isolamento & purificação , Solo/análise , Reatores Biológicos , Cicloexanos/administração & dosagem , Etanol/administração & dosagem , Fluorenos/química , Fluorenos/efeitos da radiação , Sedimentos Geológicos/química , Peróxido de Hidrogênio/administração & dosagem , Modelos Químicos , Oxirredução , Fotólise/efeitos dos fármacos , Fotólise/efeitos da radiação , Hidrocarbonetos Policíclicos Aromáticos/química , Hidrocarbonetos Policíclicos Aromáticos/efeitos da radiação , Poluentes do Solo/efeitos da radiação , Energia Solar , Temperatura , Raios Ultravioleta
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