HRID685857

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID962

Water

H2O

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID6212

Chloroform

CHCl3

HCID3772977

2,4-Dinitrophenylhydrazine

C6H6N4O4

结构：CCOP(=O)(OCC)C(N=Cc1ccccc1)C(=O)OCC(Cl)(Cl)Cl

HCID54407468

未命名化合物

PRODUCTS

生成物

HCID21529974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8354606d4e7e4a62b7a045970336b824
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:56][CH2:57][OH:58].[CH:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)=[N:34][CH:35]([C:36](=[O:37])[O:38][CH2:39][C:40]([Cl:41])([Cl:42])[Cl:43])[P:44](=[O:45])([O:46][CH2:47][CH3:48])[O:49][CH2:50][CH3:51].[CH:52]([Cl:53])([Cl:54])[Cl:55].[N+:1]([c:2]1[cH:3][c:4]([N+:5]([O-:6])=[O:7])[cH:8][cH:9][c:10]1[NH:11][NH2:12])([O-:13])=[O:14].[OH2:15].[c:16]1([CH3:17])[cH:18][cH:19][c:20]([S:21]([OH:22])(=[O:23])=[O:24])[cH:25][cH:26]1>>[NH2:34][CH:35]([C:36](=[O:37])[O:38][CH2:39][C:40]([Cl:41])([Cl:42])[Cl:43])[P:44](=[O:45])([O:46][CH2:47][CH3:48])[O:49][CH2:50][CH3:51]