HRID106052

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID53363739

[4-Fluoro-2-methoxy-5-(propan-2-yl)phenyl]boronic acid

C10H14BFO3

结构：CC1C(c2cc(C(F)(F)F)ccc2I)OC(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID178422006

未命名化合物

PRODUCTS

生成物

结构：COc1cc(F)c(C(C)C)cc1-c1ccc(C(F)(F)F)cc1C1OC(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1C

HCID178492941

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5984258d05ed465eacced70ccd7ab847
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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