Hydrochloric Acid → [4-(5-Methyl-3-trifluoromethyl-1H-pyrazol-4-yl)-phenyl]-acetonitrile
반응식
[CH3:1][c:2]1[c:3](-[c:17]2[cH:18][cH:19][c:20]([CH2:23][C:24]#[N:25])[cH:21][cH:22]2)[c:4]([C:13]([F:14])([F:15])[F:16])[n:5][n:6]1[CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][O:12]1.[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[ClH:26]>>[CH3:1][c:2]1[c:3](-[c:17]2[cH:18][cH:19][c:20]([CH2:23][C:24]#[N:25])[cH:21][cH:22]2)[c:4]([C:13]([F:14])([F:15])[F:16])[n:5][nH:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-568007eafc4340ac8dd72a7ad6bb3ee4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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