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【结 构 式】 
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【分子编号】58597 【品名】N-[4-cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide 【CA登记号】 |
【 分 子 式 】C11H7F3N2O2 【 分 子 量 】256.1840696 【元素组成】C 51.57% H 2.75% F 22.25% N 10.93% O 12.49% |
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：(III)The reaction of 4-amino-2-(trifluoromethyl)benzonitrile (I) with 2-oxopropionic acid (II) by means of SOCl2 gives the corresponding amide (III), which is finally condensed with the methyl sulfone (IV) by means of BuLi in THF.
| 【1】 Ekwuribe, N.N.; James, K.D.; A two-step synthesis of the anti-cancer drug (R,S)-bicalutamide. Synthesis (Stuttgart) 2002, 7, 850. |
| 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) | 18743 | 4-amino-2-(trifluoromethyl)benzonitrile；5-Amino-2-cyanobenzotrifluoride | 654-70-6 | C8H5F3N2 | 详情 | 详情 |
| (II) | 24066 | 2-oxopropionic acid | 127-17-3 | C3H4O3 | 详情 | 详情 |
| (III) | 58597 | N-[4-cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide | C11H7F3N2O2 | 详情 | 详情 | |
| (IV) | 46256 | 4-fluorophenyl methyl sulfone; (4-fluorophenyl)(methyl)dioxo-lambda(6)-sulfane | C7H7FO2S | 详情 | 详情 |
Extended Information