HRID1133627

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81503

Bromomethylcyclopropane

C4H7Br

HCID166653

Hydride

H-

结构：CCOC(=O)Cc1cc(Cl)c(OCC(F)(F)F)c(-c2ccc(C(F)(F)F)cc2)c1

HCID57995666

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(CC1CC1)c1cc(Cl)c(OCC(F)(F)F)c(-c2ccc(C(F)(F)F)cc2)c1

HCID57995526

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10555938aeae49619e964d10ff596afa
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

[CH:32]1([CH2:35][Br:36])[CH2:33][CH2:34]1.[Cl-:37].[Cl:1][c:2]1[cH:3][c:4]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:5][c:6](-[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13].[H-:31].[NH4+:38].[Na+:30].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43]>>[Cl:1][c:2]1[cH:3][c:4]([CH:24]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[CH2:35][CH:32]2[CH2:33][CH2:34]2)[cH:5][c:6](-[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13]