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1.
J Environ Manage ; 130: 64-71, 2013 Nov 30.
Artigo em Inglês | MEDLINE | ID: mdl-24064141

RESUMO

The mineralization of an aqueous solution of antipyrine (C11H12N2O), an emerging contaminant, using a solar photocatalytic oxidation process assisted with ferrioxalate was evaluated in a compound parabolic collector (CPC) pilot plant. Under the selected operating conditions ([H2O2] = 250 ppm, [Fe] = 14 ppm, pH = 2.7, and [(COOH)2·2H2O] = 80 ppm), 60% of TOC is removed just 5 min after treating an aqueous solution containing 50 ppm of antipyrine. The addition of oxalic acid up to a maximum concentration of 80 ppm significantly increases the mineralization rate during the first 15 min of the reaction. The synergism between the solar and dark H2O2/ferrioxalate process was quantified at 79%, calculated from the pseudo first-order mineralization rate constants. The operational costs due to the consumption of electrical energy, reagents and catalysts were calculated from the optimal conditions and compared with a novel sono-photocatalytic process using artificial UV-light. The results showed that the ferrioxalate-assisted solar photo-Fenton process was economically feasible, being able to achieve up to 60% mineralization with a total cost of 4.5 cent €/g TOC removed (1.1 €/m(3)).


Assuntos
Antipirina/química , Oxirredução , Poluentes Químicos da Água/química , Antipirina/efeitos da radiação , Redes Neurais de Computação , Oxalatos/química , Oxidantes Fotoquímicos , Projetos Piloto , Raios Ultravioleta , Poluentes Químicos da Água/efeitos da radiação , Poluição da Água/análise , Poluição da Água/prevenção & controle , Purificação da Água/métodos
2.
Rapid Commun Mass Spectrom ; 25(19): 2923-32, 2011 Oct 15.
Artigo em Inglês | MEDLINE | ID: mdl-21913271

RESUMO

The paper examines the transformation of phenazone (2,3-dimethyl-1-phenyl-3-pyrazolin-5-one), a widely used analgesic and antipyretic drug, under simulated solar irradiation in pure water, using titanium dioxide, and in river water. High-resolution mass spectrometry was employed to monitor the evolution of photoinduced processes. Initially, laboratory experiments were performed to simulate drug-transformation pathways in aqueous solution, using TiO(2) as photocatalyst. Thirteen main phenazone transformation products were detected, and full analysis of their MS and MS(n) spectra identified the diverse isobaric species. All these transformation products were themselves easily degraded, and no compounds were recognized to remain until 1h of irradiation. From these findings, a tentative degradation pathway is proposed to account for the photoinduced transformation of phenazone in natural waters. These simulation experiments were verified in the field, seeking phenazone in River Po water samples.


Assuntos
Antipirina/química , Antipirina/efeitos da radiação , Espectrometria de Massas/métodos , Titânio/química , Antipirina/toxicidade , Hidroxilação , Luz , Fotólise , Rios/química , Testes de Toxicidade , Água/química , Poluentes Químicos da Água/química , Poluentes Químicos da Água/toxicidade
3.
J Radiat Res ; 52(1): 15-23, 2011.
Artigo em Inglês | MEDLINE | ID: mdl-21139328

RESUMO

A comparative study using the pulse radiolysis technique was carried out to investigate transient absorption spectra and rate constants for the reactions of (•)OH and N(3)(•) with edaravone (3-methyl-1-phenyl-2-pyrazolin-5-one) and its four analogue compounds, 1,3-dimethyl-2-pyrazolin-5-one, 3-methyl-1-(pyridin-2-yl)-2-pyrazolin-5-one, 1-phenyl-3-trifluoromethyl-2-pyrazolin-5-one and 1-(4-chlorophenyl)-3-methyl-2-pyrazolin-5-one. The results showed that, unlike reaction mechanisms previously proposed, the phenyl group of edaravone played an important role in the reaction with (•)OH and OH adducts to the phenyl group were formed. Quantum chemical calculations also strongly supported this attribution and suggested that the most favorable site for attacks by (•)OH is the ortho position of the phenyl group. Moreover, the rate constants for the reactions of edaravone and its analogues towards (•)OH and N(3)(•) were about 8.0 × 10(9), and 4.0 × 10(9) dm(3) mol(-1) s(-1), respectively. Edaravone displayed higher reactivity compared to the others, in contrast to a previous report in which 3-methyl-1-(pyridin-2-yl)-2-pyrazolin-5-one showed the highest reactivity towards (•)OH.


Assuntos
Antipirina/análogos & derivados , Sequestradores de Radicais Livres/química , Sequestradores de Radicais Livres/efeitos da radiação , Modelos Químicos , Antipirina/química , Antipirina/efeitos da radiação , Simulação por Computador , Edaravone , Radical Hidroxila/química , Radical Hidroxila/efeitos da radiação , Nitrogênio/química , Nitrogênio/efeitos da radiação , Radiólise de Impulso/métodos
4.
Artigo em Russo | MEDLINE | ID: mdl-7941466

RESUMO

The experiments on 130 rat males have shown that the exposure of the animals' liver to centimeter microwaves enhances catalytic activity of P-450p cytochrome, an enzyme of drug microsomal metabolism. However, changes in pharmacokinetic parameters of elimination from the blood of the drugs based on microsomal substrates of hepatic enzymatic system are more dependent on the microwaves' impact on physiological factors modifying drug pharmacokinetics. This implies the necessity of pharmacokinetic investigations in each individual case of combining drugs with microwaves.


Assuntos
Antipirina/efeitos da radiação , Hexobarbital/efeitos da radiação , Microssomos Hepáticos/efeitos da radiação , Micro-Ondas , Animais , Antipirina/farmacocinética , Transporte Biológico/efeitos da radiação , Catálise/efeitos da radiação , Sistema Enzimático do Citocromo P-450/metabolismo , Sistema Enzimático do Citocromo P-450/efeitos da radiação , Hexobarbital/farmacocinética , Masculino , Microssomos Hepáticos/enzimologia , Ratos , Ratos Wistar , Albumina Sérica/metabolismo , Albumina Sérica/efeitos da radiação , Fatores de Tempo
5.
Mol Pharmacol ; 28(4): 377-80, 1985 Oct.
Artigo em Inglês | MEDLINE | ID: mdl-4058420

RESUMO

One-electron oxidation of several derivatives of pyrazolin-5-one, including the drug antipyrine, were studied by pulse radiolysis of aqueous solutions. All the compounds were found to be oxidized by Br2 rapidly (k approximately 3 X 10(8)-2 X 10(9) M-1 s-1) but considerably more slowly by weaker oxidants, such as peroxyl radicals. From redox equilibria using p-methoxyphenol and N,N,N',N'-tetramethyl-p-phenylenediamine as reference compounds, the one-electron oxidation potentials of the methyl-substituted 2-pyrazolin-5-ones were found to be in the range of 0.32-0.39 V versus normal hydrogen electrode. The relevance of these findings to the properties of the drug nafazatrom is discussed. Antipyrine was found to have a much higher oxidation potential, estimated as 1.2-1.5 V, which is rationalized on the basis of the phenyl substitution and lack of resonance stabilization of the radical cation.


Assuntos
Antipirina/efeitos da radiação , Pirazóis/efeitos da radiação , Brometos , Elétrons , Concentração de Íons de Hidrogênio , Cinética , Oxirredução , Análise Espectral , Relação Estrutura-Atividade
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