HRID172375

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID1140

Toluene

C7H8

HCID75806

Phosphine, tricyclohexyl-

C18H33P

HCID105144

Palladium(2+)

Pd+2

HCID854134

Methyl 6-bromo-2-naphthoate

C12H9BrO2

HCID2760897

Cyclopropylboronic acid

C3H7BO2

PRODUCTS

生成物

HCID54752886

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-021db477a56c4a6f9631f115cecca9f1
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:57]([O-:58])(=[O:59])[CH3:60].[C:62]([O-:63])(=[O:64])[CH3:65].[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][c:10]([Br:15])[cH:11][c:12]2[cH:13][cH:14]1.[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH:16]1([B:19]([OH:20])[OH:21])[CH2:17][CH2:18]1.[CH:22]1([P:23]([CH:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[CH:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]2)[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1.[K+:46].[K+:47].[K+:48].[OH2:56].[P:41]([O-:42])([O-:43])([O-:44])=[O:45].[Pd+2:61]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][c:10]([CH:16]3[CH2:17][CH2:18]3)[cH:11][c:12]2[cH:13][cH:14]1