HRID288423

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8071

未命名化合物

HCID123062

1-(Bromomethyl)-4-(trifluoromethyl)benzene

C8H6BrF3

HCID166653

Hydride

H-

HCID2760258

ethyl 3-oxo-3-(4-phenoxyphenyl)propanoate

C17H16O4

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(Oc2ccccc2)cc1

HCID22261618

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28f58e3940d345ffb47986b605feb05b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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