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【结 构 式】 
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【分子编号】36418 【品名】(E)-4-(2-methoxyphenyl)-3-buten-2-one 【CA登记号】 |
【 分 子 式 】C11H12O2 【 分 子 量 】176.21508 【元素组成】C 74.98% H 6.86% O 18.16% |
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：(X)The condensation of acetone (VIII) with 2-methoxybenzaldehyde (IX) by means of NaOH gives 2-methoxybenzalacetone (X), which is reduced with H2 over Raney-Ni in ethanol to yield 4-(2-methoxyphenyl)-2-butanone (XI). The Grignard reaction of (XI) with methylmagnesium iodide in ether affords 1,1-dimethyl-3-(2-methoxyphenyl) propanol (XII), which by reaction with NaCN by means of H2SO4 in acetic acid affords N-[1,1-dimethyl-3-(2-methoxyphenyl)propyl]formamide (XIII). Finally, this compound is hydrolyzed with refluxing 5N NaOH to give (II).
| 【1】 Olsson, O.A.T.; Persson, N.H.A.; Svensson, L.A.; Waldeck, C.B.; Wetterlin, K.J.L.; EP 0004835 . |
| 【2】 Castaner, J.; Blancafort, P.; Serradell, M.N.; D-2343. Drugs Fut 1982, 7, 1, 17. |
| 中间体序号 | 中间体编号 | 品名 | CAS号 | 分子式 | 供应商 | 用于合成 |
|---|---|---|---|---|---|---|
| (II) | 36422 | 3-(2-methoxyphenyl)-1,1-dimethylpropylamine; 4-(2-methoxyphenyl)-2-methyl-2-butanamine | C12H19NO | 详情 | 详情 | |
| (VIII) | 23199 | 2-Propanone; Acetone; beta-ketopropane; chevron acetone;propan-2-one； Dimethyl formaldehyde; Dimethyl ketone; dimethylketal; Ketone propane; Methyl ketone; Propanone; Pyroacetic acid; Pyroacetic ether | 67-64-1 | C3H6O | 详情 | 详情 |
| (IX) | 12568 | 2-Methoxybenzaldehyde; o-Methoxybenzaldehyde | 135-02-4 | C8H8O2 | 详情 | 详情 |
| (X) | 36418 | (E)-4-(2-methoxyphenyl)-3-buten-2-one | C11H12O2 | 详情 | 详情 | |
| (XI) | 36419 | 4-(2-methoxyphenyl)-2-butanone | C11H14O2 | 详情 | 详情 | |
| (XII) | 36420 | 4-(2-methoxyphenyl)-2-methyl-2-butanol | C12H18O2 | 详情 | 详情 | |
| (XIII) | 36421 | 3-(2-methoxyphenyl)-1,1-dimethylpropylformamide | C13H19NO2 | 详情 | 详情 |
Extended Information