Electric Literature of 827-25-8, When developing chemical systems it’s of course important to gain a deep understanding of the chemical reaction process. 827-25-8, Name is 2-Bromo-4-chloro-6-nitrophenylamine, SMILES is BrC1=C(C(=CC(=C1)Cl)[N+](=O)[O-])N, belongs to isothiazole compound. In a article, author is Contini, A, introduce new discover of the category.
The mechanism for the nucleophilic reaction between methylthiolate and 4-bromo-3-methylamino-isothiazole 1,1-dioxide has been investigated on the basis of ab initio, MP2 and DFT calculations. Comparison of the computational results with the experimental findings led to the proposal of an unusual nucleophilic addition-elimination reaction mechanism proceeding through a 1,5-sigmatropic hydrogen shift. (c) 2005 Elsevier B.V. All rights reserved.
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Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com