HRID283585

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID962

Water

H2O

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID12247

4-Penten-2-ol

C5H10O

HCID80271

Phosphine, tris(2-methylphenyl)-

C21H21P

HCID105144

Palladium(2+)

Pd+2

HCID140102

Benzenamine, 3-bromo-N,N-dimethyl-

C8H10BrN

PRODUCTS

生成物

HCID70124731

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-32b24cfe0e994414a6207f17e5474402
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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