Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations
Autor(a) principal: | |
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Data de Publicação: | 2018 |
Outros Autores: | , , |
Tipo de documento: | Artigo |
Idioma: | eng |
Título da fonte: | Repositório Institucional da UNESP |
Texto Completo: | http://dx.doi.org/10.1007/s11356-018-2555-4 http://hdl.handle.net/11449/171121 |
Resumo: | The purpose of this study was to investigate the aqueous phase photochemical behavior of enoxacin (ENO), an antibiotic selected as a model pollutant of emerging concern. The second-order reaction rate constants of ENO with hydroxyl radicals (HO●) and singlet oxygen (1O2) were determined at pH 3, 7, and 9. Also, the rate constants of the electron transfer reaction between ENO and triplet states of chromophoric dissolved organic matter (3CDOM*) are reported for the first time, based on anthraquinone-2-sulfonate (AQ2S) as CDOM proxy. The sunlight-driven direct and indirect ENO degradation in the presence of dissolved organic matter (DOM) is also discussed. The results show that direct photolysis, which occurs more rapidly at higher pH, along with the reactions with HO● and 3AQ2S*, is the key pathway involved in ENO degradation. The ENO zwitterions, prevailing at pH 7, show kENO, HO●, kENO,1O2, and kENO,3AQ2S* of (14.0 ± 0.8) × 1010, (3.9 ± 0.2) × 106, and (61.5 ± 0.7) × 108 L mol−1 s−1, respectively, whose differences at pH 3, 7, and 9 are due to ENO pH-dependent speciation and reactivity. These k values, along with the experimental ENO photolysis quantum yield, were used in mathematical simulations for predicting ENO persistence in sunlit natural waters. According to the simulations, dissolved organic matter and water depth are expected to have the highest impacts on ENO half-life, varying from a few hours to days in summertime, depending on the concentrations of relevant waterborne species (organic matter, NO3−, NO2−, HCO3−). |
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Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulationsAntibioticsDirect and indirect photodegradationDissolved organic matterEnoxacinEnvironmental photochemical fateMathematical modelingReactive photo-induced speciesThe purpose of this study was to investigate the aqueous phase photochemical behavior of enoxacin (ENO), an antibiotic selected as a model pollutant of emerging concern. The second-order reaction rate constants of ENO with hydroxyl radicals (HO●) and singlet oxygen (1O2) were determined at pH 3, 7, and 9. Also, the rate constants of the electron transfer reaction between ENO and triplet states of chromophoric dissolved organic matter (3CDOM*) are reported for the first time, based on anthraquinone-2-sulfonate (AQ2S) as CDOM proxy. The sunlight-driven direct and indirect ENO degradation in the presence of dissolved organic matter (DOM) is also discussed. The results show that direct photolysis, which occurs more rapidly at higher pH, along with the reactions with HO● and 3AQ2S*, is the key pathway involved in ENO degradation. The ENO zwitterions, prevailing at pH 7, show kENO, HO●, kENO,1O2, and kENO,3AQ2S* of (14.0 ± 0.8) × 1010, (3.9 ± 0.2) × 106, and (61.5 ± 0.7) × 108 L mol−1 s−1, respectively, whose differences at pH 3, 7, and 9 are due to ENO pH-dependent speciation and reactivity. These k values, along with the experimental ENO photolysis quantum yield, were used in mathematical simulations for predicting ENO persistence in sunlit natural waters. According to the simulations, dissolved organic matter and water depth are expected to have the highest impacts on ENO half-life, varying from a few hours to days in summertime, depending on the concentrations of relevant waterborne species (organic matter, NO3−, NO2−, HCO3−).Research Group in Advanced Oxidation Processes (AdOx) Chemical Systems Engineering Center Department of Chemical Engineering University of São Paulo, Av. Prof. Luciano Gualberto, tr. 3Department of Energy Engineering São Paulo State University (UNESP), Av. BarrageirosDepartment of Energy Engineering São Paulo State University (UNESP), Av. BarrageirosUniversidade de São Paulo (USP)Universidade Estadual Paulista (Unesp)Lastre-Acosta, Arlen MabelBarberato, BrunaParizi, Marcela Prado Silva [UNESP]Teixeira, Antonio Carlos Silva Costa2018-12-11T16:54:00Z2018-12-11T16:54:00Z2018-06-21info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/article1-11application/pdfhttp://dx.doi.org/10.1007/s11356-018-2555-4Environmental Science and Pollution Research, p. 1-11.1614-74990944-1344http://hdl.handle.net/11449/17112110.1007/s11356-018-2555-42-s2.0-850487830012-s2.0-85048783001.pdf0369255510931164Scopusreponame:Repositório Institucional da UNESPinstname:Universidade Estadual Paulista (UNESP)instacron:UNESPengEnvironmental Science and Pollution Research0,858info:eu-repo/semantics/openAccess2023-12-09T06:23:02Zoai:repositorio.unesp.br:11449/171121Repositório InstitucionalPUBhttp://repositorio.unesp.br/oai/requestopendoar:29462024-08-05T19:52:11.686068Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)false |
dc.title.none.fl_str_mv |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
title |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
spellingShingle |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations Lastre-Acosta, Arlen Mabel Antibiotics Direct and indirect photodegradation Dissolved organic matter Enoxacin Environmental photochemical fate Mathematical modeling Reactive photo-induced species |
title_short |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
title_full |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
title_fullStr |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
title_full_unstemmed |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
title_sort |
Direct and indirect photolysis of the antibiotic enoxacin: kinetics of oxidation by reactive photo-induced species and simulations |
author |
Lastre-Acosta, Arlen Mabel |
author_facet |
Lastre-Acosta, Arlen Mabel Barberato, Bruna Parizi, Marcela Prado Silva [UNESP] Teixeira, Antonio Carlos Silva Costa |
author_role |
author |
author2 |
Barberato, Bruna Parizi, Marcela Prado Silva [UNESP] Teixeira, Antonio Carlos Silva Costa |
author2_role |
author author author |
dc.contributor.none.fl_str_mv |
Universidade de São Paulo (USP) Universidade Estadual Paulista (Unesp) |
dc.contributor.author.fl_str_mv |
Lastre-Acosta, Arlen Mabel Barberato, Bruna Parizi, Marcela Prado Silva [UNESP] Teixeira, Antonio Carlos Silva Costa |
dc.subject.por.fl_str_mv |
Antibiotics Direct and indirect photodegradation Dissolved organic matter Enoxacin Environmental photochemical fate Mathematical modeling Reactive photo-induced species |
topic |
Antibiotics Direct and indirect photodegradation Dissolved organic matter Enoxacin Environmental photochemical fate Mathematical modeling Reactive photo-induced species |
description |
The purpose of this study was to investigate the aqueous phase photochemical behavior of enoxacin (ENO), an antibiotic selected as a model pollutant of emerging concern. The second-order reaction rate constants of ENO with hydroxyl radicals (HO●) and singlet oxygen (1O2) were determined at pH 3, 7, and 9. Also, the rate constants of the electron transfer reaction between ENO and triplet states of chromophoric dissolved organic matter (3CDOM*) are reported for the first time, based on anthraquinone-2-sulfonate (AQ2S) as CDOM proxy. The sunlight-driven direct and indirect ENO degradation in the presence of dissolved organic matter (DOM) is also discussed. The results show that direct photolysis, which occurs more rapidly at higher pH, along with the reactions with HO● and 3AQ2S*, is the key pathway involved in ENO degradation. The ENO zwitterions, prevailing at pH 7, show kENO, HO●, kENO,1O2, and kENO,3AQ2S* of (14.0 ± 0.8) × 1010, (3.9 ± 0.2) × 106, and (61.5 ± 0.7) × 108 L mol−1 s−1, respectively, whose differences at pH 3, 7, and 9 are due to ENO pH-dependent speciation and reactivity. These k values, along with the experimental ENO photolysis quantum yield, were used in mathematical simulations for predicting ENO persistence in sunlit natural waters. According to the simulations, dissolved organic matter and water depth are expected to have the highest impacts on ENO half-life, varying from a few hours to days in summertime, depending on the concentrations of relevant waterborne species (organic matter, NO3−, NO2−, HCO3−). |
publishDate |
2018 |
dc.date.none.fl_str_mv |
2018-12-11T16:54:00Z 2018-12-11T16:54:00Z 2018-06-21 |
dc.type.status.fl_str_mv |
info:eu-repo/semantics/publishedVersion |
dc.type.driver.fl_str_mv |
info:eu-repo/semantics/article |
format |
article |
status_str |
publishedVersion |
dc.identifier.uri.fl_str_mv |
http://dx.doi.org/10.1007/s11356-018-2555-4 Environmental Science and Pollution Research, p. 1-11. 1614-7499 0944-1344 http://hdl.handle.net/11449/171121 10.1007/s11356-018-2555-4 2-s2.0-85048783001 2-s2.0-85048783001.pdf 0369255510931164 |
url |
http://dx.doi.org/10.1007/s11356-018-2555-4 http://hdl.handle.net/11449/171121 |
identifier_str_mv |
Environmental Science and Pollution Research, p. 1-11. 1614-7499 0944-1344 10.1007/s11356-018-2555-4 2-s2.0-85048783001 2-s2.0-85048783001.pdf 0369255510931164 |
dc.language.iso.fl_str_mv |
eng |
language |
eng |
dc.relation.none.fl_str_mv |
Environmental Science and Pollution Research 0,858 |
dc.rights.driver.fl_str_mv |
info:eu-repo/semantics/openAccess |
eu_rights_str_mv |
openAccess |
dc.format.none.fl_str_mv |
1-11 application/pdf |
dc.source.none.fl_str_mv |
Scopus reponame:Repositório Institucional da UNESP instname:Universidade Estadual Paulista (UNESP) instacron:UNESP |
instname_str |
Universidade Estadual Paulista (UNESP) |
instacron_str |
UNESP |
institution |
UNESP |
reponame_str |
Repositório Institucional da UNESP |
collection |
Repositório Institucional da UNESP |
repository.name.fl_str_mv |
Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP) |
repository.mail.fl_str_mv |
|
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1808129132181061632 |