HRID1113974

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID581436

4-(Bromomethyl)-1,2-difluorobenzene

C7H5BrF2

结构：COC(=O)c1cc(-c2ccc(OC)c(F)c2)n[nH]c1=O

HCID21991432

未命名化合物

HCID21991662

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(-c2ccc(OC)c(F)c2)nn(Cc2ccc(F)c(F)c2)c1=O

HCID21991666

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28f87eac4a5a4d6fbaad708204783039
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

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