HRID1209467

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID6344

Dichloromethane

CH2Cl2

HCID14487

Diisobutylaluminum hydride

C8H19Al

结构：CCOC(=O)c1cc(C)n(-c2cccc(-c3ccccc3OC(F)(F)F)c2)n1

HCID11417896

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C=O)nn1-c1cccc(-c2ccccc2OC(F)(F)F)c1

HCID11427956

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-21b46feb20ae4aa895d4c049a379c601
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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