HRID1550663

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID15458

tert-Butyl acrylate

C7H12O2

HCID105144

Palladium(2+)

Pd+2

HCID68654530

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)C=Cc1ccc(C(=C2CCCCC2)c2ccc(O)c(F)c2)cc1

HCID68976302

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae3302ded81147598ab6cacb149b4634
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[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][c:11]([F:16])[c:12]([OH:15])[cH:13][cH:14]2)=[C:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7]1.[C:23]([CH:24]=[CH2:25])(=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31].[C:39]([O-:40])(=[O:41])[CH3:42].[C:44]([O-:45])(=[O:46])[CH3:47].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[OH2:48].[Pd+2:43]>>[c:2]1([CH:25]=[CH:24][C:23](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][c:11]([F:16])[c:12]([OH:15])[cH:13][cH:14]2)=[C:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7]1