2,3,6-Trifluorophenol → N-(2',3',6'-trifluorophenyl)-N-chloroacetyl-4-ethylaniline
반응식
[Cl:11][CH2:12][C:13](=[O:14])[NH:15][c:16]1[cH:17][cH:18][c:19]([CH2:22][CH3:23])[cH:20][cH:21]1.[F:1][c:2]1[c:3]([OH:10])[c:4]([F:9])[cH:5][cH:6][c:7]1[F:8]>>[F:1][c:2]1[c:3]([N:15]([C:13]([CH2:12][Cl:11])=[O:14])[c:16]2[cH:17][cH:18][c:19]([CH2:22][CH3:23])[cH:20][cH:21]2)[c:4]([F:9])[cH:5][cH:6][c:7]1[F:8]참가 물질
3
출처 및 근거
- ORD 기록
- ord-7ed46222a25143f0acc01584899dbdd2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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