Ethanol → 1,1,1-Trifluoro-2-octyl p-aminobenzoate
반응식
[CH3:24][CH2:25][OH:26].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[O:10][CH:11]([C:12]([F:13])([F:14])[F:15])[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[cH:22][cH:23]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[O:10][CH:11]([C:12]([F:13])([F:14])[F:15])[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[cH:22][cH:23]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-b3844ec8bc3b443782d70d35cc194930
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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