HRID822949

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

HCID105144

Palladium(2+)

Pd+2

HCID19606250

未命名化合物

HCID19606310

1-(2-Hydroxy-3-iodophenyl)ethan-1-one

C8H7IO2

PRODUCTS

生成物

结构：CC(=O)c1cccc(C=Cc2ccc(OCCCCc3ccccc3)cc2)c1O

HCID54226951

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-16c7af16fb3c46ffb33ee999ef5b6f76
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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