Yang Jian-Xin, Wang Xiang-Hui, Tan Xue-Mei, Wang Yin, Lin Qiang
Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3409. doi: 10.1107/S160053681104791X. Epub 2011 Nov 23.
The title compound, C(12)H(13)NO(3)S, was synthesised by the reaction of benzo[d]isothia-zol-3(2H)-one with butyl alcohol in toluene. The benzoisothia-zolone ring system is almost planar with a mean deviation of 0.041 (1) Å. In the crystal, mol-ecules are linked by weak inter-molecular C-H⋯O hydrogen bonds.
标题化合物C(12)H(13)NO(3)S是通过苯并[d]异噻唑-3(2H)-酮与丁醇在甲苯中反应合成的。苯并异噻唑酮环系几乎是平面的,平均偏差为0.041 (1) Å。在晶体中,分子通过弱的分子间C-H⋯O氢键相连。