HRID208645

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5943

Carbon tetrachloride

CCl4

HCID6547

Azobisisobutyronitrile

C8H12N4

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

结构：Cc1c(F)c(F)c(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

HCID58782894

未命名化合物

HCID178525505

未命名化合物

PRODUCTS

生成物

结构：Fc1c(F)c(F)c(-c2c(F)c(F)c(CBr)c(F)c2F)c(F)c1F

HCID86591121

4-(Bromomethyl)-2,2′,3,3′,4′,5,5′,6,6′-nonafluoro-1,1′-biphenyl

C13H2BrF9

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1e075c59d7094949b3fc3ad8052f1ac8
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:23][N:24]=[C:25]([OH:26])[CH2:27][CH2:28][C:29]([OH:30])=[O:31].[C:52]([Cl:53])([Cl:54])([Cl:55])[Cl:56].[CH3:1][c:2]1[c:3]([F:22])[c:4]([F:21])[c:5](-[c:10]2[c:11]([F:20])[c:12]([F:19])[c:13]([F:18])[c:14]([F:17])[c:15]2[F:16])[c:6]([F:9])[c:7]1[F:8].[N:32]#[C:33][C:34]([N:35]=[N:36][C:37]([C:38]#[N:39])([CH3:40])[CH3:41])([CH3:42])[CH3:43].[O:44]=[C:45]1[N:46]([Br:47])[C:48](=[O:49])[CH2:50][CH2:51]1>>[CH2:1]([c:2]1[c:3]([F:22])[c:4]([F:21])[c:5](-[c:10]2[c:11]([F:20])[c:12]([F:19])[c:13]([F:18])[c:14]([F:17])[c:15]2[F:16])[c:6]([F:9])[c:7]1[F:8])[Br:23]