HRID2345078

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

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID105144

Palladium(2+)

Pd+2

HCID263416

5-iodo-2,4-dimethoxypyrimidine

C6H7IN2O2

HCID24901774

(2-Chloro-5-fluoropyridin-3-yl)boronic acid

C5H4BClFNO2

PRODUCTS

生成物

HCID58994239

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d422068c768421cb2936ca3dcac66af
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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