HRID134373

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

2 次

HCID1140

Toluene

C7H8

HCID6331

Borane

H3B

2 次

HCID6422

未命名化合物

HCID6495

2,2-Dimethoxypropane

C5H12O2

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID74218

5-Chloro-2-nitroaniline

C6H5ClN2O2

PRODUCTS

产物

HCID10775027

Benzenamine, 5-chloro-N-(1-methylethyl)-2-nitro-

C9H11ClN2O2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-315fc1289b3c4995a925f2054ac63e9b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[B:32].[BH3:33].[CH3:12][O:13][C:14]([CH3:15])([CH3:16])[O:17][CH3:18].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[CH3:53][CH2:54][CH2:55][CH2:56][CH2:57][CH3:58].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N+:9](=[O:10])[O-:11])[c:6]([NH2:7])[cH:8]1.[OH:19][C:20]([C:21]([F:22])([F:23])[F:24])=[O:25].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[n:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N+:9](=[O:10])[O-:11])[c:6]([NH:7][CH:14]([CH3:15])[CH3:16])[cH:8]1