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Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate
Quinones and quinone-containing organics have potential of activating persulfate to produce sulfate radical. In this work, the optimal condition for quinone activation of persulfate was investigated. It was found representative monoaromatics were degraded fastest in alkaline environment (pH 10.0), b...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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Frontiers Media S.A.
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8440822/ https://www.ncbi.nlm.nih.gov/pubmed/34540795 http://dx.doi.org/10.3389/fchem.2021.580643 |
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author | Shi, Jiaqi Long, Tao Zhou, Yuxuan Wang, Lei Jiang, Cuiping Pan, Dongguo Zhu, Xin |
author_facet | Shi, Jiaqi Long, Tao Zhou, Yuxuan Wang, Lei Jiang, Cuiping Pan, Dongguo Zhu, Xin |
author_sort | Shi, Jiaqi |
collection | PubMed |
description | Quinones and quinone-containing organics have potential of activating persulfate to produce sulfate radical. In this work, the optimal condition for quinone activation of persulfate was investigated. It was found representative monoaromatics were degraded fastest in alkaline environment (pH 10.0), but excessive alkalinity restrained the reaction instead. The mechanisms to explain this phenomenon were speculated. The effect of initial quinone concentration on persulfate oxidation was also investigated at pH 10.0. In addition, a quantitative structure-activity relationship model was established with 15 kinds of monoaromatics, which revealed the most negative atomic net charges on carbon atom played an important role on degradation rates. Chemicals with a smaller [Formula: see text] were easier oxidized in quinone-activate system. This finding helps further exploration of effective activator in alkaline environment. |
format | Online Article Text |
id | pubmed-8440822 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | Frontiers Media S.A. |
record_format | MEDLINE/PubMed |
spelling | pubmed-84408222021-09-16 Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate Shi, Jiaqi Long, Tao Zhou, Yuxuan Wang, Lei Jiang, Cuiping Pan, Dongguo Zhu, Xin Front Chem Chemistry Quinones and quinone-containing organics have potential of activating persulfate to produce sulfate radical. In this work, the optimal condition for quinone activation of persulfate was investigated. It was found representative monoaromatics were degraded fastest in alkaline environment (pH 10.0), but excessive alkalinity restrained the reaction instead. The mechanisms to explain this phenomenon were speculated. The effect of initial quinone concentration on persulfate oxidation was also investigated at pH 10.0. In addition, a quantitative structure-activity relationship model was established with 15 kinds of monoaromatics, which revealed the most negative atomic net charges on carbon atom played an important role on degradation rates. Chemicals with a smaller [Formula: see text] were easier oxidized in quinone-activate system. This finding helps further exploration of effective activator in alkaline environment. Frontiers Media S.A. 2021-09-01 /pmc/articles/PMC8440822/ /pubmed/34540795 http://dx.doi.org/10.3389/fchem.2021.580643 Text en Copyright © 2021 Shi, Long, Zhou, Wang, Jiang, Pan and Zhu. https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms. |
spellingShingle | Chemistry Shi, Jiaqi Long, Tao Zhou, Yuxuan Wang, Lei Jiang, Cuiping Pan, Dongguo Zhu, Xin Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title | Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title_full | Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title_fullStr | Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title_full_unstemmed | Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title_short | Efficiency and Quantitative Structure-Activity Relationship of Monoaromatics Oxidation by Quinone-Activated Persulfate |
title_sort | efficiency and quantitative structure-activity relationship of monoaromatics oxidation by quinone-activated persulfate |
topic | Chemistry |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8440822/ https://www.ncbi.nlm.nih.gov/pubmed/34540795 http://dx.doi.org/10.3389/fchem.2021.580643 |
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