HRID1143559

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4653

p-Fluorophenethylamine

C8H10FN

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID130500

未命名化合物

HCID23067883

4-(1,1,2,2,2-Pentafluoroethyl)benzoic acid

C9H5F5O2

PRODUCTS

生成物

结构：O=C(NCCc1ccc(F)cc1)c1ccc(C(F)(F)C(F)(F)F)cc1

HCID86613992

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d0b53b905504f1daa16389a88bd002d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:27][N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[F:17][c:18]1[cH:19][cH:20][c:21]([CH2:24][CH2:25][NH2:26])[cH:22][cH:23]1.[F:1][C:2]([C:3]([F:4])([F:5])[F:6])([c:7]1[cH:8][cH:9][c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15]1)[F:16].[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[cH:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[F:1][C:2]([C:3]([F:4])([F:5])[F:6])([c:7]1[cH:8][cH:9][c:10]([C:11](=[O:13])[NH:26][CH2:25][CH2:24][c:21]2[cH:20][cH:19][c:18]([F:17])[cH:23][cH:22]2)[cH:14][cH:15]1)[F:16]