HRID1552179

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

2 次

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID98089

1-(1-Naphthyl)ethylamine

C12H13N

HCID2724942

未命名化合物

HCID11298612

3-(Trifluoromethyl)benzenepropanal

C10H9F3O

PRODUCTS

生成物

结构：CC(NCCCc1cccc(C(F)(F)F)c1)c1cccc2ccccc12

HCID6101856

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-14e006213bf34706ae3d8a5ed970a0df
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[CH3:45][C:46](=[O:47])[OH:48].[Cl:49][CH2:50][Cl:51].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:9][CH2:10][CH:11]=[O:12])[cH:6][cH:7][cH:8]1)([F:13])[F:14].[Na+:41].[Na+:43].[OH-:42].[OH2:44].[c:15]1([CH:25]([CH3:26])[NH2:27])[cH:16][cH:17][cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]12>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:9][CH2:10][CH2:11][NH:27][CH:25]([c:15]2[cH:16][cH:17][cH:18][c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[CH3:26])[cH:6][cH:7][cH:8]1)([F:13])[F:14]