Acetic Acid → Trifluoroacetic acid
Reaction equation
[CH3:1][N:2]([C:3]([CH:4]=[CH:5][c:6]1[cH:7][n:8][c:9]2[c:14]([cH:15]1)[CH2:13][CH2:12][C:11](=[O:16])[NH:10]2)=[O:17])[CH2:18][c:19]1[o:20][c:21]2[c:22]([c:23]1[CH3:24])[cH:25][cH:26][cH:27][cH:28]2.[CH3:36][C:37](=[O:38])[OH:39].[OH:29][C:30](=[O:31])[C:32]([F:33])([F:34])[F:35]>>[CH3:1][N:2]([C:3]([CH:4]=[CH:5][c:6]1[cH:7][n:8][c:9]2[c:14]([cH:15]1)[CH2:13][CH2:12][C:11](=[O:16])[NH:10]2)=[O:17])[CH2:18][c:19]1[o:20][c:21]2[c:22]([c:23]1[CH3:24])[cH:25][cH:26][cH:27][cH:28]2.[O:29]=[C:30]([OH:31])[C:32]([F:33])([F:34])[F:35]Participants
5
Sources & evidence
- ORD record
- ord-11c0eaf47ff2496e84bf982a5385748c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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