HRID2339590

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23005339

[2-(Benzyloxy)-5-(trifluoromethyl)phenyl]boronic acid

C14H12BF3O3

HCID69507739

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cc(C)cc(C2=C(c3cc(C(F)(F)F)ccc3OCc3ccccc3)CCC2)c1

HCID69508136

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dbc0ea88e4a9487481d48be4a14e9e02
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:22]([CH3:23])[O:24][C:25]([c:26]1[cH:27][c:28]([C:33]2=[C:34]([Br:38])[CH2:35][CH2:36][CH2:37]2)[cH:29][c:30]([CH3:32])[cH:31]1)=[O:39].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([O:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:7]([B:9]([OH:10])[OH:11])[cH:8]1)([F:20])[F:21]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([O:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:7]([C:34]2=[C:33]([c:28]3[cH:27][c:26]([C:25]([O:24][CH2:22][CH3:23])=[O:39])[cH:31][c:30]([CH3:32])[cH:29]3)[CH2:37][CH2:36][CH2:35]2)[cH:8]1)([F:20])[F:21]