HRID165503

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COC(=O)Cc1ccc(F)c(B2OC(C)(C)C(C)(C)O2)c1

HCID46739456

Methyl [4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate

C15H20BFO4

结构：CCN(Cc1ccccc1)C(=O)OCc1cc(C(F)(F)F)ccc1Br

HCID67430273

未命名化合物

PRODUCTS

生成物

结构：CCN(Cc1ccccc1)C(=O)OCc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)OC)ccc1F

HCID67430680

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be9ae5bc58c4458c9d8e4a7ea9687859
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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