HRID1552715

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID10482

Acetyl bromide

C2H3BrO

结构：CCCCCCCCCCCCCCCCCCCCCCOc1ccc2c(c1)C(O)(c1ccc(Cl)cc1)c1ccccc1-2

HCID46927722

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCCCCCCCOc1ccc2c(c1)C(Br)(c1ccc(Cl)cc1)c1ccccc1-2

HCID46927723

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e82ccaf125464545a2d9903c7416145f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:45](=[O:46])([CH3:47])[Br:48].[CH2:1]([CH2:2][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][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[O:23][c:24]1[cH:25][c:26]2[c:34]([cH:35][cH:36]1)-[c:33]1[c:28]([cH:29][cH:30][cH:31][cH:32]1)[C:27]2([OH:37])[c:38]1[cH:39][cH:40][c:41]([Cl:44])[cH:42][cH:43]1.[CH:49]([Cl:50])([Cl:51])[Cl:52]>>[CH2:1]([CH2:2][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][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[O:23][c:24]1[cH:25][c:26]2[c:34]([cH:35][cH:36]1)-[c:33]1[c:28]([cH:29][cH:30][cH:31][cH:32]1)[C:27]2([c:38]1[cH:39][cH:40][c:41]([Cl:44])[cH:42][cH:43]1)[Br:48]