HRID178325

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6061

Methylhydrazine

CH6N2

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID6661

1,3-Dimethyl-2-imidazolidinone

C5H10N2O

HCID24841

未命名化合物

PRODUCTS

生成物

HCID18983008

3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid

C6H6F2N2O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1780bb594369498b86ffbde79d62826a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:16][O:17][CH:18]=[C:19]([C:20](=[O:21])[C:22]([F:23])([F:24])[F:25])[C:26]([O:27][CH3:28])=[O:29].[CH3:2][Si:3]([Cl:4])([CH3:5])[CH3:6].[CH3:30][NH:31][NH2:32].[CH3:59][OH:60].[CH3:7][N:8]1[CH2:9][CH2:10][N:11]([CH3:12])[C:13]1=[O:14].[F:33][CH:34]([c:35]1[n:36][n:37]([CH3:44])[cH:38][c:39]1[C:40](=[O:41])[O:42][CH3:43])[F:45].[F:46][CH:47]([F:48])[N:49]1[CH:50]([C:51]([O:52][CH3:53])=[O:54])[CH:55]=[CH:56][N:57]1[CH3:58].[I:15].[Mg:1]>>[F:33][CH:34]([c:35]1[n:36][n:37]([CH3:44])[cH:38][c:39]1[C:40](=[O:41])[OH:42])[F:45]

反应方程式

反应物

Methanol

Methylhydrazine

Chlorotrimethylsilane

1,3-Dimethyl-2-imidazolidinone

Hydrogen iodide

Magnesium

未命名化合物

未命名化合物

未命名化合物

生成物

3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid