HRID1563635

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

2 次

HCID19660

Carbonate

CO3-2

HCID66827

Boronic acid, phenyl-

C6H7BO2

结构：c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

HCID82124

Phosphine, 1,4-butanediylbis[diphenyl-

C28H28P2

HCID105144

Palladium(2+)

Pd+2

HCID5360545

Sodium

HCID86610754

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID86055398

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ee4e29fe34a3401cad4b53517c3691b0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:2][c:3]1[cH:4][c:5]([S:13](=[O:14])(=[O:15])[OH:16])[c:6]2[cH:7][cH:8][n:9][cH:10][c:11]2[cH:12]1.[C:63]([O-:64])(=[O:65])[CH3:66].[C:68]([O-:69])(=[O:70])[CH3:71].[ClH:62].[Na+:26].[Na+:27].[Na:1].[O-:28][C:29](=[O:30])[O-:31].[OH:17][B:18]([OH:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[Pd+2:67].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH2:40][CH2:41][CH2:42][CH2:43][P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[ClH:62].[c:3]1(-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:4][c:5]([S:13](=[O:14])(=[O:15])[OH:16])[c:6]2[cH:7][cH:8][n:9][cH:10][c:11]2[cH:12]1