Ethanol → (3-Hydroxy-5-trifluoromethyl-phenyl)-acetic acid methyl ester
반응식
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1)=[O:23].[CH3:24][CH2:25][OH:26]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([OH:15])[cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1)=[O:23]참가 물질
3
출처 및 근거
- ORD 기록
- ord-3af20b6f4aa34af6a39b93c80ce492fe
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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