HRID1167963

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID76612

Butanoic acid, 4-chloro-, methyl ester

C5H9ClO2

结构：O=C([O-])c1cc(-c2sc3ccccc3c2Cc2ccc(OCCN3CCCC3)cc2)ccc1OCCN1CCCC1.[Na+]

HCID23663891

未命名化合物

PRODUCTS

生成物

结构：O=C(O)CCCOc1ccc(-c2sc3ccccc3c2Cc2ccc(OCCN3CCCC3)cc2)cc1C(=O)[O-].O=C(O)CCCOc1ccc(-c2sc3ccccc3c2Cc2ccc(OCCN3CCCC3)cc2)cc1C(=O)[O-].[Na+].[Na+]

HCID131724072

未命名化合物

收率 54%

PROCEDURE

实验过程

The title compound was prepared in 54% yield by essentially following the procedures outlined in above in Example 1, Part A, from the phenol of Example 1, Part I, above, and methyl 4-chlorobutyrate.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e428b5caa6e4901a8ad379493cbd1e0
来源数据集: uspto-grants-2003_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06620837B1
来源说明: uspto-grants-2003_09

反应 SMILES

[Na+:1].N1(C[CH2:8][O:9][C:10]2[CH:18]=[CH:17][C:16]([C:19]3[S:23][C:22]4[CH:24]=[CH:25][CH:26]=[CH:27][C:21]=4[C:20]=3[CH2:28][C:29]3[CH:34]=[CH:33][C:32]([O:35][CH2:36][CH2:37][N:38]4[CH2:42][CH2:41][CH2:40][CH2:39]4)=[CH:31][CH:30]=3)=[CH:15][C:11]=2[C:12]([O-:14])=[O:13])CCCC1.ClC[CH2:45][CH2:46][C:47]([O:49]C)=[O:48]>>[Na+:1].[Na+:1].[C:47]([CH2:46][CH2:45][CH2:8][O:9][C:10]1[CH:18]=[CH:17][C:16]([C:19]2[S:23][C:22]3[CH:24]=[CH:25][CH:26]=[CH:27][C:21]=3[C:20]=2[CH2:28][C:29]2[CH:30]=[CH:31][C:32]([O:35][CH2:36][CH2:37][N:38]3[CH2:42][CH2:41][CH2:40][CH2:39]3)=[CH:33][CH:34]=2)=[CH:15][C:11]=1[C:12]([O-:14])=[O:13])([OH:49])=[O:48].[C:47]([CH2:46][CH2:45][CH2:8][O:9][C:10]1[CH:18]=[CH:17][C:16]([C:19]2[S:23][C:22]3[CH:24]=[CH:25][CH:26]=[CH:27][C:21]=3[C:20]=2[CH2:28][C:29]2[CH:30]=[CH:31][C:32]([O:35][CH2:36][CH2:37][N:38]3[CH2:42][CH2:41][CH2:40][CH2:39]3)=[CH:33][CH:34]=2)=[CH:15][C:11]=1[C:12]([O-:14])=[O:13])([OH:49])=[O:48]