On May 15, 2021, Li, Mingxue; Mei, Qiong; Wei, Bo; An, Zexiu; Sun, Jianfei; Xie, Ju; He, Maoxia published an article.Recommanded Product: 1,2-Dimethoxybenzene The title of the article was Mechanism and kinetics of ClO·-mediated degradation of aromatic compounds in aqueous solution: DFT and QSAR studies. And the article contained the following:
The action of ClO· is more prominent than HO· and Cl· in the advanced oxidation degradation of some pollutants. However, studies on the pollutant degradation mechanism and kinetics by ClO· are limited. In this study, 43 different kind of aromatic compounds which are important anthropogenic and natural water pollutants were selected as models to investigate their ClO· oxidation mechanism and kinetics computationally. The results showed that radical adduct formation (RAF) rather than single electron transfer (SET) reaction was prominent in ClO·-initiated reactions of aromatic compounds In subsequent reactions of the ClO-adduct, the Cl end of the -OCl moiety shifted to the benzene ring, which was the key to hydroxylation and chlorination of aromatic compounds by ClO·. The calculated ClO· initiated reaction rate constants (k·ClO) of aromatic compounds were 102-1010 M-1 s-1. ClO· was highly reactive to phenolates, anilines and alkoxy/hydroxyl aromatic compounds Upon the deprotonation of phenol to phenolate, the k·ClO value increased by 4 orders of magnitude. The k·ClO values of alkoxybenzenes were higher for compounds with shorter alkyl side chains and more alkoxy substituents. The k·ClO increased for anilines with longer alkyl side chains. The k·ClO quant. structure-activity relationships (QSARs) models were developed to predict the reactivity of ClO· to complex aromatic compounds in aquatic systems. The experimental process involved the reaction of 1,2-Dimethoxybenzene(cas: 91-16-7).Recommanded Product: 1,2-Dimethoxybenzene
The Article related to density functional theory degradation chlorine oxide radical wastewater treatment, Waste Treatment and Disposal: Chemical Treatment Of Aqueous Wastes and other aspects.Recommanded Product: 1,2-Dimethoxybenzene
Referemce:
Ether – Wikipedia,
Ether | (C2H5)2O – PubChem