Acetone → [2,6-Difluoro-4-(1-hydroxy-1-methyl-ethyl)-phenyl]-acetaldehyde
반응식
[CH3:18][C:19](=[O:20])[CH3:21].[ClH:17].[F:1][c:2]1[cH:3][c:4]([C:13]([CH3:14])([CH3:15])[OH:16])[cH:5][c:6]([F:12])[c:7]1[CH:8]=[CH:9][O:10][CH3:11]>>[F:1][c:2]1[cH:3][c:4]([C:13]([CH3:14])([CH3:15])[OH:16])[cH:5][c:6]([F:12])[c:7]1[CH2:8][CH:9]=[O:10]참가 물질
4
출처 및 근거
- ORD 기록
- ord-aa2289fa8cc94d558375ab43b366c53b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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