HRID1564714

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8083

Morpholine

C4H9NO

HCID8857

Ethyl acetate

C4H8O2

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

HCID105144

Palladium(2+)

Pd+2

HCID3376779

2-Bromo-4-iodoanisole

C7H6BrIO

HCID4574913

未命名化合物

PRODUCTS

生成物

HCID67429791

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72504b5bb18143b4b03b95fe093bb5fe
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:1][c:2]1[c:3]([O:9][CH3:10])[cH:4][cH:5][c:6]([I:8])[cH:7]1.[C:17]([P:18]([C:19]([CH3:20])([CH3:21])[CH3:22])[C:23]([CH3:24])([CH3:25])[CH3:26])([CH3:27])([CH3:28])[CH3:29].[C:43]([O-:44])(=[O:45])[CH3:46].[C:48]([O-:49])(=[O:50])[CH3:51].[CH2:11]1[CH2:12][O:13][CH2:14][CH2:15][NH:16]1.[CH3:30][C:31]([CH3:32])([O-:33])[CH3:34].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[Na+:35].[OH2:58].[Pd+2:47]>>[Br:1][c:2]1[c:3]([O:9][CH3:10])[cH:4][cH:5][c:6]([N:16]2[CH2:11][CH2:12][O:13][CH2:14][CH2:15]2)[cH:7]1