HRID167809

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

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID65522

2-Amino-4,6-dichloropyrimidine

C4H3Cl2N3

HCID105144

Palladium(2+)

Pd+2

HCID45097455

(5-Bromo-2-methylphenyl)boronic acid

C7H8BBrO2

PRODUCTS

生成物

HCID86004341

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-405645ff99fc44d7a558812a166f41d4
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

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