HRID1535605

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID15458

tert-Butyl acrylate

C7H12O2

HCID105144

Palladium(2+)

Pd+2

HCID14888701

5-[(4-Bromophenyl)methyl]-2-(1,1-dimethylethyl)-2H-tetrazole

C12H15BrN4

PRODUCTS

生成物

HCID6581

Acrylic acid

C3H4O2

HCID22417276

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-37dd4d2a60014f21a333b13bd9edafea
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]([CH2:8][c:9]2[n:10][n:11][n:12]([C:14]([CH3:15])([CH3:16])[CH3:17])[n:13]2)[cH:6][cH:7]1.[C:18]([CH:19]=[CH2:20])(=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[O-:40][C:41]([CH3:42])=[O:43].[O-:44][C:45]([CH3:46])=[O:47].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[Pd+2:39]>>[C:18]([CH:19]=[CH2:20])(=[O:21])[OH:22].[c:2]1([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:3][cH:4][c:5]([CH2:8][c:9]2[n:10][n:11][n:12]([C:14]([CH3:15])([CH3:16])[CH3:17])[n:13]2)[cH:6][cH:7]1