HRID88187

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID2736225

4-BROMO-2-CHLORO-5-FLUOROBENZOIC ACID

C7H3BrClFO2

HCID2737531

4-Amino-1-methylpiperidine

C6H14N2

PRODUCTS

生成物

HCID68680732

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1d270b75177f4023be4f125847b6aaf8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([Cl:12])[c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]1[F:11].[CH3:37][N:38]1[CH2:39][CH2:40][CH:41]([NH2:44])[CH2:42][CH2:43]1.[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[P-:13]([F:14])([F:15])([F:16])([F:17])([F:18])[F:19].[n:20]1([O:21][C:22]([N:23]([CH3:24])[CH3:25])=[N+:26]([CH3:27])[CH3:28])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[n:35][n:36]1>>[Br:1][c:2]1[cH:3][c:4]([Cl:12])[c:5]([C:6](=[O:8])[NH:44][CH:41]2[CH2:40][CH2:39][N:38]([CH3:37])[CH2:43][CH2:42]2)[cH:9][c:10]1[F:11]