HRID1240229

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

2 次

HCID260

Hydrogen Bromide

BrH

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID5460504

Phosphonium

H4P+

HCID57123282

未命名化合物

PRODUCTS

生成物

HCID259

Bromide

Br-

结构：CC(C=CC1=C(C)C(=O)C(O)CC1(C)C)=CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

HCID72460968

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a2fedc9d01fe4f2a83df79114eb50799
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br-:20].[Br-:40].[BrH:19].[CH2:42]([Cl:43])[Cl:44].[OH:1][CH:2]1[C:3](=[O:18])[C:4]([CH3:17])=[C:5]([CH:10]=[CH:11][C:12]([CH:13]=[CH2:14])([OH:15])[CH3:16])[C:6]([CH3:8])([CH3:9])[CH2:7]1.[PH4+:41].[c:21]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[Br-:19].[OH:1][CH:2]1[C:3](=[O:18])[C:4]([CH3:17])=[C:5]([CH:10]=[CH:11][C:12](=[CH:13][CH2:14][P+:27]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH3:16])[C:6]([CH3:8])([CH3:9])[CH2:7]1