HRID288127

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

HCID2775221

1-[4-(3-bromopropoxy)-2-hydroxy-3-propylphenyl]ethanone

C14H19BrO3

PRODUCTS

生成物

HCID259

Bromide

Br-

结构：CCCc1c(OCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)ccc(C(C)=O)c1O

HCID19877021

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e93e461a2d4641c4958f66fbd2b34d11
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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