Ethanol → tert-Butyl 2-amino-5-methylbenzoate
반응식
[BH4-:22].[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH:15][C:16](=[O:17])[C:18]([F:19])([F:20])[F:21])[c:6]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[cH:14]1.[CH3:25][CH2:26][OH:27].[Na+:23].[OH2:24]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH2:15])[c:6]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[cH:14]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e3e59ecde6b947bca0a1278912ead8a8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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