HRID959367

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID13131235

4-Bromo-5-methoxy-1-methyl-1H-pyrazole

C5H7BrN2O

结构：COc1ccc(F)c(Cl)c1C(C)c1c[nH]c2ncc(B3OC(C)(C)C(C)(C)O3)cc12

HCID178491821

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(F)c(Cl)c1C(C)c1c[nH]c2ncc(-c3cnn(C)c3OC)cc12

HCID178491825

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6aa71fd00c89412a9a74cb43abad15f0
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

[Br:1][c:2]1[cH:3][n:4][n:5]([CH3:9])[c:6]1[O:7][CH3:8].[C:40](=[O:41])([O-:42])[O-:43].[Cl:10][c:11]1[c:12]([CH:20]([CH3:21])[c:22]2[cH:23][nH:24][c:25]3[n:26][cH:27][c:28]([B:31]4[O:32][C:33]([CH3:34])([CH3:35])[C:36]([CH3:37])([CH3:38])[O:39]4)[cH:29][c:30]23)[c:13]([O:18][CH3:19])[cH:14][cH:15][c:16]1[F:17].[Cl:46][CH2:47][Cl:48].[K+:44].[K+:45].[O:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1>>[c:2]1(-[c:28]2[cH:27][n:26][c:25]3[nH:24][cH:23][c:22]([CH:20]([c:12]4[c:11]([Cl:10])[c:16]([F:17])[cH:15][cH:14][c:13]4[O:18][CH3:19])[CH3:21])[c:30]3[cH:29]2)[cH:3][n:4][n:5]([CH3:9])[c:6]1[O:7][CH3:8]