Ethanol → 1-tert-butyl-5-(5-chloro-isoxazol-3-yl)-1H-pyrazole-4-carboxylic acid
반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:10]1-[c:11]1[n:12][o:13][c:14]([Cl:16])[cH:15]1.[CH3:23][CH2:24][OH:25].[Li+:21].[OH-:22]>>[O:3]=[C:4]([OH:5])[c:6]1[cH:7][n:8][n:9]([C:17]([CH3:18])([CH3:19])[CH3:20])[c:10]1-[c:11]1[n:12][o:13][c:14]([Cl:16])[cH:15]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-101ab572d4ec44b8882f7ea0d54305ca
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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