HRID183383

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID10442

1,3-Propanediol

C3H8O2

结构：COC(=O)c1ccc(NCCCCCCCCCCCCCC[Si](C)(C)C)cc1

HCID20198250

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCCCCCCCCCCCCCNc1ccc(C(=O)OCCCO)cc1

HCID20198238

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97978c3dc7d54a6ab49e7b069ec0d73b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:30]([CH2:31][CH2:32][OH:33])[OH:34].[CH3:1][Si:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:26][cH:27]1)([CH3:28])[CH3:29].[c:35]1([CH3:36])[cH:37][cH:38][c:39]([S:40]([OH:41])(=[O:42])=[O:43])[cH:44][cH:45]1>>[CH3:1][Si:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH2:25][CH2:31][CH2:32][OH:33])[cH:26][cH:27]1)([CH3:28])[CH3:29]