HRID2127550

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

HCID25134

Boron tribromide

BBr3

结构：COc1ccc(F)cc1C(C)(C)CC(O)(CNc1cccc2nc(C(F)(F)F)ccc12)C(F)(F)F

HCID21948797

未命名化合物

PRODUCTS

生成物

结构：CC(C)(CC(O)(CNc1cccc2nc(C(F)(F)F)ccc12)C(F)(F)F)c1cc(F)ccc1O

HCID21948931

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-015f7ae5a9f740438c83a9c00927ddce
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

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