title: [Prediction of common buffer catalysis in hydrolysis of fenchlorazole-ethyl].
abstract: The purpose of this study was to elucidate the effects of temperatures, pH levels and buffer catalysis on the hydrolysis of FCE. The hydrolysis of FCE follows first-order kinetics at different pH levels and temperatures. FCE hydrolysis rates are greatly increased at elevated pH levels and temperatures. The maximum contribution of buffer catalysis to the hydrolysis of FCE was assessed based on application of the Bronsted equations for general acid-base catalysis. The results suggest that the buffer solutions play an obvious catalysis role in hydrolysis of FCE and the hydrolysis rates of FCE are quickened by the buffer solutions. Besides, the buffer catalysis capacity of different buffer solutions is diverse, and the buffer catalysis capacity at different pH levels with the same buffer solutions is different, too. The phosphate buffer at pH = 7 shows the maximal buffer catalysis capacity. The hydrolysis rate constants of FCE as a function of temperature and pH, which were remedied by the buffer catalysis factor, were mathematically combined to predict the hydrolytic dissipation of FCE. The equation suggests that the hydrolysis half-lives of FCE ranged from 7 d to 790 d. Hydrolysis metabolites of FCE were identified by liquid chromatography-mass spectrometry. In basic conditions (pH 8-10), fenchlorazole was formed via breakdown of the ester bond of the safener.
authors.affiliation: Department of Environmental Science and Technology, Dalian University of Technology, Dalian 116024, China. abcd2000807@sohu.com
authors.forename: Jing
authors.initials: J
authors.lastname: Lin
authors.forename: Jing-wen
authors.initials: JW
authors.lastname: Chen
authors.forename: Si-yu
authors.initials: SY
authors.lastname: Zhang
authors.forename: Xi-yun
authors.initials: XY
authors.lastname: Cai
authors.forename: Xian-liang
authors.initials: XL
authors.lastname: Qiao
mesh_terms: D002021:Buffers; D002384:Catalysis; D004787:Environmental Pollution / Q000517:prevention & control*; D006868:Hydrolysis; D014230:Triazoles / Q000737:chemistry*; D014874:Water Pollutants, Chemical / Q000737:chemistry*
chemical_list: D002021:Buffers; D014230:Triazoles; D014874:Water Pollutants, Chemical; C514516:fenchlorazole-ethyl