HRID201668

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID6344

Dichloromethane

CH2Cl2

HCID28557

18-Crown-6

C12H24O6

HCID4574913

未命名化合物

HCID5460504

Phosphonium

H4P+

结构：CC1=C(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)C(C)(C)CCC1

HCID10950921

未命名化合物

HCID12330254

3-Iodo-4-methylbenzaldehyde

C8H7IO

PRODUCTS

生成物

HCID68947344

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4435d1ee7c4642cc9069997ab958f634
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

[Br-:1].[CH3:49][C:50]([CH3:51])([O-:52])[CH3:53].[Cl:66][CH2:67][Cl:68].[I:55][c:56]1[cH:57][c:58]([CH:59]=[O:60])[cH:61][cH:62][c:63]1[CH3:64].[K+:54].[O:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36][O:37][CH2:38][CH2:39][O:40][CH2:41][CH2:42][O:43][CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[PH4+:65].[c:2]1([P+:3]([c:4]2[cH:5][cH:6][cH:7][cH:8][cH:19]2)([CH2:9][C:10]2=[C:11]([CH3:18])[CH2:12][CH2:13][CH2:14][C:15]2([CH3:16])[CH3:17])[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH:9]([C:10]1=[C:11]([CH3:18])[CH2:12][CH2:13][CH2:14][C:15]1([CH3:16])[CH3:17])=[CH:59][c:58]1[cH:57][c:56]([I:55])[c:63]([CH3:64])[cH:62][cH:61]1