HRID937879

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID8071

未命名化合物

HCID28179

Fluoride

F-

HCID105144

Palladium(2+)

Pd+2

HCID2734320

4-tert-Butylphenylboronic acid

C10H15BO2

HCID68520808

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1sc(C(F)(F)F)c(C#N)c1-c1ccc(C(C)(C)C)cc1

HCID68525497

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d7c669011ca347858519eb93b6284051
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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