Acetic Acid → 2-Amino-4-chloro-3-trifluoromethylphenol
반응식
[CH3:16][CH2:17][O:18][C:19](=[O:20])[CH3:21].[CH3:22][C:23](=[O:24])[OH:25].[Cl:1][c:2]1[c:3]([C:12]([F:13])([F:14])[F:15])[c:4]([N+:9]([O-:10])=[O:11])[c:5]([OH:8])[cH:6][cH:7]1.[Fe:26].[OH2:27]>>[Cl:1][c:2]1[c:3]([C:12]([F:13])([F:14])[F:15])[c:4]([NH2:9])[c:5]([OH:8])[cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-9c40db7cff5942628a5a96f9e2f7ed7b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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