HRID1561155

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID11205

Carbon tetrabromide

CBr4

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

结构：N#Cc1ccc(N2CCC(O)(CCO)CC2)cc1C(F)(F)F

HCID67501124

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc(N2CCC(O)(CCBr)CC2)cc1C(F)(F)F

HCID67502568

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7af77250cf274a949bfb5b14a9ce2553
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:23](=[O:24])([O-:25])[O-:26].[C:48]([Br:49])([Br:50])([Br:51])[Br:52].[Cl:53][CH2:54][Cl:55].[K+:27].[K+:28].[OH:1][C:2]1([CH2:20][CH2:21][OH:22])[CH2:3][CH2:4][N:5]([c:8]2[cH:9][c:10]([C:16]([F:17])([F:18])[F:19])[c:11]([C:12]#[N:13])[cH:14][cH:15]2)[CH2:6][CH2:7]1.[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[OH:1][C:2]1([CH2:20][CH2:21][Br:49])[CH2:3][CH2:4][N:5]([c:8]2[cH:9][c:10]([C:16]([F:17])([F:18])[F:19])[c:11]([C:12]#[N:13])[cH:14][cH:15]2)[CH2:6][CH2:7]1