Methanol → 1-(2-tert-butoxyethyl)-5-trifluoromethyl-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]([CH2:15][CH2:16][O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]1[C:11]([F:12])([F:13])[F:14].[CH3:24][OH:25].[Li+:22].[OH-:23].[OH2:26]>>[O:3]=[C:4]([OH:5])[c:6]1[cH:7][n:8][n:9]([CH2:15][CH2:16][O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]1[C:11]([F:12])([F:13])[F:14]참가 물질
6
출처 및 근거
- ORD 기록
- ord-3fc11d84228c46b0b8cbcab2a6ce939a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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