HRID688785

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

HCID68855369

N-{[2-Fluoro-4-(trifluoromethyl)phenyl]methyl}butan-1-amine

C12H15F4N

HCID69391758

未命名化合物

PRODUCTS

生成物

结构：CCCCN(Cc1ccc(C(F)(F)F)cc1F)C(=O)COc1ccc(CC(OCC)C(=O)OCC)cc1

HCID178448952

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cd7d56c07c9a446d8253f9e4d21a08db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[B-:48]([F:49])([F:50])([F:51])[F:52].[CH2:18]([CH3:19])[O:20][CH:21]([CH2:22][c:23]1[cH:24][cH:25][c:26]([O:27][CH2:28][C:29](=[O:30])[OH:31])[cH:32][cH:33]1)[C:34](=[O:35])[O:36][CH2:37][CH3:38].[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][CH2:6][c:7]1[c:8]([F:17])[cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1.[CH2:70]([Cl:71])[Cl:72].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[n:53]1([O:54][C:55]([N:56]([CH3:57])[CH3:58])=[N+:59]([CH3:60])[CH3:61])[c:62]2[cH:63][cH:64][cH:65][cH:66][c:67]2[n:68][n:69]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([CH2:6][c:7]1[c:8]([F:17])[cH:9][c:10]([C:13]([F:14])([F:15])[F:16])[cH:11][cH:12]1)[C:29]([CH2:28][O:27][c:26]1[cH:25][cH:24][c:23]([CH2:22][CH:21]([O:20][CH2:18][CH3:19])[C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:33][cH:32]1)=[O:30]