HRID119627

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID485423

N-{[4-(Trifluoromethyl)phenyl]methyl}butan-1-amine

C12H16F3N

HCID69391758

未命名化合物

PRODUCTS

生成物

结构：CCCCN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1ccc(CC(OCC)C(=O)OCC)cc1

HCID178448951

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d686bfd6485948a7bed4f544eb1c8def
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

[B-:47]([F:48])([F:49])([F:50])[F:51].[CH2:17]([CH3:18])[O:19][CH:20]([CH2:21][c:22]1[cH:23][cH:24][c:25]([O:26][CH2:27][C:28](=[O:29])[OH:30])[cH:31][cH:32]1)[C:33](=[O:34])[O:35][CH2:36][CH3:37].[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][CH2:6][c:7]1[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1.[CH2:69]([Cl:70])[Cl:71].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[n:52]1([O:53][C:54]([N:55]([CH3:56])[CH3:57])=[N+:58]([CH3:59])[CH3:60])[c:61]2[cH:62][cH:63][cH:64][cH:65][c:66]2[n:67][n:68]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1)[C:28]([CH2:27][O:26][c:25]1[cH:24][cH:23][c:22]([CH2:21][CH:20]([O:19][CH2:17][CH3:18])[C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:32][cH:31]1)=[O:29]