Ethanol → 4-Amino-2,3-dimethylbenzonitrile
반응식
[CH3:17][CH2:18][OH:19].[CH3:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][cH:10][c:11]([N+:14]([O-:15])=[O:16])[c:12]1[CH3:13].[Sn:1]([Cl:2])[Cl:3]>>[CH3:4][c:5]1[c:6]([C:7]#[N:8])[cH:9][cH:10][c:11]([NH2:14])[c:12]1[CH3:13]참가 물질
4
출처 및 근거
- ORD 기록
- ord-16ca5859e989421ab6a37910cb84ea35
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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