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【结 构 式】

【分子编号】32733

【品名】sodium 1,2-benzisoxazol-3-ylmethanesulfonate

【CA登记号】

【 分 子 式 】C8H6NNaO4S

【 分 子 量 】235.195748

【元素组成】C 40.85% H 2.57% N 5.96% Na 9.77% O 27.21% S 13.63%

与该中间体有关的原料药合成路线共 2 条

合成路线1

该中间体在本合成路线中的序号:(II)

The reaction of 3-bromomethyl-1,2-benzisoxazole (I) with sodium sulfite in hot methanol - water gives sodium 1,2-benzisoxazole-3-methanesulfonate (II), which by reaction with refluxing POCl3 is converted into 1,2-benzisoxazole-3-methanesufonyl chloride (III). Finally, this compound is treated with dry NH3 in ethyl acetate.

1 Uno, H.; et al. (Dainippon Pharmaceutical Co., Ltd.); Methane-sulfonamide derivatives, the preparation thereof and composition comprising the same. US 4172896 .
2 Castaner, J.; Owen, R.T.; Blancafort, P.; Serradell, M.N.; AD-810. Drugs Fut 1980, 5, 8, 387.
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(I) 32732 3-(bromomethyl)-1,2-benzisoxazole C8H6BrNO 详情 详情
(II) 32733 sodium 1,2-benzisoxazol-3-ylmethanesulfonate C8H6NNaO4S 详情 详情
(III) 32734 1,2-benzisoxazol-3-ylmethanesulfonyl chloride C8H6ClNO3S 详情 详情

合成路线2

该中间体在本合成路线中的序号:(II)

 

1 Naddaka V, Adin I .Klopfer E, et al. 2006. Two crystalline forms of sodium l,2-benzisoxazole-3-methanesulfonate, and processes for the preparation and use thereof in the synthesis of zonisarrude. US 20Q6009644
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(I) 32732 3-(bromomethyl)-1,2-benzisoxazole C8H6BrNO 详情 详情
(II) 32733 sodium 1,2-benzisoxazol-3-ylmethanesulfonate C8H6NNaO4S 详情 详情
(III) 32734 1,2-benzisoxazol-3-ylmethanesulfonyl chloride C8H6ClNO3S 详情 详情
Extended Information