HRID149530

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8846

Butyl acrylate

C7H12O2

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID31272

Butyl acetate

C6H12O2

HCID105144

Palladium(2+)

Pd+2

HCID44754868

2-Chloro-5-fluoropyridin-3-amine

C5H4ClFN2

PRODUCTS

生成物

HCID57815341

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8767a6d7b17f4580b326159b3e5945c1
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

[CH3:1][CH2:2][CH2:3][CH2:4][O:5][C:6](=[O:7])[CH:8]=[CH2:9].[CH3:53][CH2:54][CH2:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cl:10][c:11]1[n:12][cH:13][c:14]([F:18])[cH:15][c:16]1[NH2:17].[Na+:38].[Na+:39].[O-:40][C:41](=[O:42])[O-:43].[O-:45][C:46]([CH3:47])=[O:48].[O-:49][C:50]([CH3:51])=[O:52].[OH2:61].[Pd+2:44].[c:19]1([P:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[CH3:1][CH2:2][CH2:3][CH2:4][O:5][C:6](=[O:7])[CH:8]=[CH:9][c:11]1[n:12][cH:13][c:14]([F:18])[cH:15][c:16]1[NH2:17]