HRID620451

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID13765519

4-(5-Heptylpyrimidin-2-yl)benzoic acid

C18H22N2O2

HCID21246706

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCc1ccc(OC(=O)c2ccc(-c3ncc(CCCCCCC)cn3)cc2)c(C#N)c1

HCID54309069

未命名化合物

PROCEDURE

实验过程

29.8 g of 4-(5-heptylpyrimidin-2-yl)-benzoic acid (obtained from 4-(5-heptylpyrimidin-2-yl)-benzonitrile by saponification) and 25.9 g of 2-cyano-4-decylphenol are esterified with one another as described in Example 22 with addition of 21.0 g of dicyclohexylcarbodiimide. 2-Cyano-4-decylphenyl 4-(5-heptylpyrimidin-2-yl)-benzoate is obtained.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-372a9ac66e5140e68af8b4cd141e90a7
来源数据集: uspto-grants-1989_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US04820839
来源说明: uspto-grants-1989_04

反应 SMILES

[CH2:1]([C:8]1[CH:9]=[N:10][C:11]([C:14]2[CH:22]=[CH:21][C:17]([C:18]([OH:20])=[O:19])=[CH:16][CH:15]=2)=[N:12][CH:13]=1)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7].[C:23]([C:25]1[CH:30]=[C:29]([CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])[CH:28]=[CH:27][C:26]=1O)#[N:24].C1(N=C=NC2CCCCC2)CCCCC1>>[CH2:1]([C:8]1[CH:9]=[N:10][C:11]([C:14]2[CH:22]=[CH:21][C:17]([C:18]([O:20][C:26]3[CH:27]=[CH:28][C:29]([CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40])=[CH:30][C:25]=3[C:23]#[N:24])=[O:19])=[CH:16][CH:15]=2)=[N:12][CH:13]=1)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7]