4-Fluorophenol → 4-[{3-[(4-Fluorophenyl)oxy]propyl}(2,2,2-trifluoroethyl)amino]-2-(trifluoromethyl)benzonitrile
반응식
[F:23][c:24]1[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]1.[OH:1][CH2:2][CH2:3][CH2:4][N:5]([c:6]1[cH:7][c:8]([C:14]([F:15])([F:16])[F:17])[c:9]([C:10]#[N:11])[cH:12][cH:13]1)[CH2:18][C:19]([F:20])([F:21])[F:22]>>[O:1]([CH2:2][CH2:3][CH2:4][N:5]([c:6]1[cH:7][c:8]([C:14]([F:15])([F:16])[F:17])[c:9]([C:10]#[N:11])[cH:12][cH:13]1)[CH2:18][C:19]([F:20])([F:21])[F:22])[c:27]1[cH:26][cH:25][c:24]([F:23])[cH:29][cH:28]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-ab41061deb2841988ef581a8898c3e10
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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