Ethanol → 5-Chloro-3-(trifluoromethyl)-1-benzothiophene-2-carboxylic acid
반응식
[CH2:3]([CH3:4])[O:5][C:6](=[O:7])[c:8]1[c:9]([C:18]([F:19])([F:20])[F:21])[c:10]2[c:11]([s:12]1)[cH:13][cH:14][c:15]([Cl:17])[cH:16]2.[CH3:22][CH2:23][OH:24].[Na+:2].[OH-:1]>>[O:5]=[C:6]([OH:7])[c:8]1[c:9]([C:18]([F:19])([F:20])[F:21])[c:10]2[c:11]([s:12]1)[cH:13][cH:14][c:15]([Cl:17])[cH:16]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-6b7d36266b854e4a8c881c7d2d70feae
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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