Toluene → 6-Hydroxy-3-methyl-4-trifluoromethanesulfonyloxy-phthalic Acid Dimethyl Ester
반응식
[CH2:28]([NH:29][CH2:30][CH3:31])[CH3:32].[CH3:1][O:2][C:3]([c:4]1[c:5]([C:6](=[O:7])[O:8][CH3:9])[c:10]([CH3:26])[c:11]([O:18][S:19](=[O:20])(=[O:21])[C:22]([F:23])([F:24])[F:25])[cH:12][c:13]1[O:14][CH2:15][CH:16]=[CH2:17])=[O:27].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([C:6](=[O:7])[O:8][CH3:9])[c:10]([CH3:26])[c:11]([O:18][S:19](=[O:20])(=[O:21])[C:22]([F:23])([F:24])[F:25])[cH:12][c:13]1[OH:14])=[O:27]참가 물질
4
출처 및 근거
- ORD 기록
- ord-bef41d0998f14862a1760e88cfa3ccfa
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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