HRID807408

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID312

Chloride

Cl-

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID105144

Palladium(2+)

Pd+2

HCID583124

Methyl 4-vinylbenzoate

C10H10O2

HCID10776365

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C=Cc2ccc3c(c2)C(=O)CC3(C)C)cc1

HCID54336622

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2402dd65b45c4097a05e7d61acd2095b
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

[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[C:8](=[O:11])[CH2:7][C:6]2([CH3:12])[CH3:13].[C:26](=[O:27])([OH:28])[O-:29].[C:62]([O-:63])(=[O:64])[CH3:65].[C:67]([O-:68])(=[O:69])[CH3:70].[CH2:39]([N+:40]([CH2:41][CH2:42][CH2:43][CH3:44])([CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH2:51][CH3:52])[CH2:53][CH2:54][CH3:55].[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[CH3:56][N:57]([CH3:58])[CH:59]=[O:60].[CH3:71][CH2:72][O:73][C:74]([CH3:75])=[O:76].[CH:14](=[CH2:15])[c:16]1[cH:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]1.[Cl-:38].[Cl:77][CH2:78][Cl:79].[Na+:30].[OH2:37].[OH2:61].[Pd+2:66]>>[c:2]1([CH:15]=[CH:14][c:16]2[cH:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]2)[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[C:8](=[O:11])[CH2:7][C:6]2([CH3:12])[CH3:13]