HRID695391

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID67602

1-Bromo-3,5-bis(trifluoromethyl)benzene

C8H3BrF6

HCID234275

4-chloro-2,6-dimethylquinoline

C11H10ClN

HCID178506228

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2nc(C)cc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c2c1

HCID22721470

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6029681af53b4824a7351e7ff5139fc1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br-:1].[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[Cl:37][c:38]1[cH:39][c:40]([CH3:49])[n:41][c:42]2[cH:43][cH:44][c:45]([CH3:48])[cH:46][c:47]12.[F:17][C:18]([F:19])([F:20])[c:21]1[cH:22][c:23]([Br:24])[cH:25][c:26]([C:27]([F:28])([F:29])[F:30])[cH:31]1.[F:2][C:3]([c:4]1[cH:5][c:6]([Mg+:14])[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1)([F:15])[F:16].[OH2:50]>>[F:2][C:3]([c:4]1[cH:5][c:6](-[c:38]2[cH:39][c:40]([CH3:49])[n:41][c:42]3[cH:43][cH:44][c:45]([CH3:48])[cH:46][c:47]23)[cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1)([F:15])[F:16]