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【结 构 式】 
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【分子编号】22975 【品名】4-[(4-fluorophenyl)sulfonyl]aniline; 4-[(4-fluorophenyl)sulfonyl]phenylamine 【CA登记号】 |
【 分 子 式 】C12H10FNO2S 【 分 子 量 】251.2813432 【元素组成】C 57.36% H 4.01% F 7.56% N 5.57% O 12.73% S 12.76% |
与该中间体有关的原料药合成路线共 1 条
合成路线1
该中间体在本合成路线中的序号：(V)1) The reaction of p-fluorothiophenol (I) with p-chloronitrobenzene (II) in 50% aqueous ethanol in the presence of sodium carbonate gives p-fluorophenyl-p-nitrophenyl sulfide (III), which is then oxidized with 30% aqueous hydrogen peroxide in glacial acetic acid to give the corresponding sulfone (IV). The catalytic reduction of the sulfone (IV) with Raney Nickel in p-dioxane affords p-(p-fluorophenylsulfonyl)aniline (V), which is then acetylated with acetic anhydride in tetrahydrofuran to give title compound.
| 【1】 Durr, F.E.; Lang, S.A. Jr.; Shang Wang, B.; Ruszala-Mallon, V.; Lin, Y.-i.; Fields, T.L.; CL-259,763. Drugs Fut 1987, 12, 5, 431. |
| 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) | 22971 | 4-fluorobenzenethiol; 4-fluorophenylhydrosulfide; 4-Fluorothiophenol | 371-42-6 | C6H5FS | 详情 | 详情 |
| (II) | 13909 | 1-Chloro-4-nitrobenzene; p-Nitrochlorobenzene | 100-00-5 | C6H4ClNO2 | 详情 | 详情 |
| (III) | 22973 | 4-fluorophenyl 4-nitrophenyl sulfide; 1-fluoro-4-[(4-nitrophenyl)sulfanyl]benzene | C12H8FNO2S | 详情 | 详情 | |
| (IV) | 22974 | 4-fluorophenyl 4-nitrophenyl sulfone; (4-fluorophenyl)(4-nitrophenyl)dioxo-lambda(6)-sulfane | C12H8FNO4S | 详情 | 详情 | |
| (V) | 22975 | 4-[(4-fluorophenyl)sulfonyl]aniline; 4-[(4-fluorophenyl)sulfonyl]phenylamine | C12H10FNO2S | 详情 | 详情 |
Extended Information