Ethyl 2-(4-bromophenyl)-2-methylpropanoate → 2-Methyl-2-(4-(5-(trifluoromethyl)pyridin-2-yl)phenyl)propanoic acid
반응식
[Br:25][c:26]1[cH:27][cH:28][c:29]([C:30]([CH3:31])([CH3:32])[C:33]([O:34][CH2:35][CH3:36])=[O:37])[cH:38][cH:39]1.[CH3:1][C:2]([C:3](=[O:4])[O:5][CH2:6][CH3:7])([CH3:8])[c:9]1[cH:10][cH:11][c:12](-[c:15]2[n:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[cH:13][cH:14]1>>[CH3:1][C:2]([C:3](=[O:4])[OH:5])([CH3:8])[c:9]1[cH:10][cH:11][c:12](-[c:15]2[n:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[cH:13][cH:14]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-79a4c5458c764a09a4932690dd9fd900
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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