HRID831147

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID1848511

1-(CHLOROACETYL)-4-(4-FLUOROPHENYL)PIPERAZINE

C12H14ClFN2O

HCID2736430

4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazole

C5H4BrF3N2

PRODUCTS

生成物

结构：Cc1c(Br)c(C(F)(F)F)nn1CC(=O)N1CCN(c2ccc(F)cc2)CC1

HCID21071006

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82b717f62a1a4743b4d26aeb70867404
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[c:3]([C:8]([F:9])([F:10])[F:11])[n:4][nH:5][c:6]1[CH3:7].[C:40]([O:41][CH2:42][CH3:43])(=[O:44])[CH3:45].[CH3:46][CH2:47][CH2:48][CH2:49][CH2:50][CH3:51].[Cl:18][CH2:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][N:25]([c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]2)[CH2:26][CH2:27]1.[K+:12].[K+:13].[O-:14][C:15]([O-:16])=[O:17].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39]>>[Br:1][c:2]1[c:3]([C:8]([F:9])([F:10])[F:11])[n:4][n:5]([CH2:19][C:20](=[O:21])[N:22]2[CH2:23][CH2:24][N:25]([c:28]3[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]3)[CH2:26][CH2:27]2)[c:6]1[CH3:7]