HRID2150258

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID7237

o-Xylene

C8H10

HCID11776

Triphenylphosphine

C18H15P

HCID76583

3-Bromobenzaldehyde

C7H5BrO

HCID123138

Ethyl radical

C2H5

HCID517981

Methyl 3-(bromomethyl)benzoate

C9H9BrO2

结构：COC(=O)c1cccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1

HCID10051286

未命名化合物

PRODUCTS

生成物

HCID54224658

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ddf5eb53652d45dd86460762360ba70c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br-:10].[Br:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][cH:8][cH:9]1.[C:11](=[O:12])([O:13][CH3:14])[c:15]1[cH:16][c:17]([CH2:18][P+:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]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:38][cH:39][cH:40]1.[CH2:72][CH3:73].[CH3:41][O:42][C:43](=[O:44])[c:45]1[cH:46][cH:47][cH:48][c:49]([CH2:50][Br:51])[cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[c:74]1([CH3:75])[c:76]([CH3:77])[cH:78][cH:79][cH:80][cH:81]1>>[Br:1][c:2]1[cH:3][c:4]([CH:5]=[CH:18][c:17]2[cH:16][c:15]([C:11](=[O:12])[O:13][CH3:14])[cH:40][cH:39][cH:38]2)[cH:7][cH:8][cH:9]1