Benzene → 3-[4-(Trifluoromethyl)phenyl]-2-propynal
반응식
[CH2:21]([Cl:22])[Cl:23].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:9]#[C:10][CH2:11][OH:12])[cH:7][cH:8]1)([F:13])[F:14].[cH:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:9]#[C:10][CH:11]=[O:12])[cH:7][cH:8]1)([F:13])[F:14]참가 물질
4
출처 및 근거
- ORD 기록
- ord-625c49d22d2e414ca08ef9318b8fd8b1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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