Trifluoroacetic acid → Trifluoroacetic acid
Reaction equation
[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[N:8][C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[NH:16][C:17](=[O:18])[CH:19]2[N:20]([c:24]3[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]3)[CH2:21][CH2:22][CH2:23]2)[cH:34][c:35]([Cl:44])[c:36]1[NH:37][C:38]([CH2:39][N:40]([CH3:41])[CH3:42])=[O:43].[F:45][C:46]([C:47](=[O:48])[OH:49])([F:50])[F:51]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7]([NH2:8])=[N:16][C:17](=[O:18])[CH:19]2[N:20]([c:24]3[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]3)[CH2:21][CH2:22][CH2:23]2)[cH:34][c:35]([Cl:44])[c:36]1[NH:37][C:38]([CH2:39][N:40]([CH3:41])[CH3:42])=[O:43].[F:45][C:46]([C:47](=[O:48])[OH:49])([F:50])[F:51]Participants
4
Sources & evidence
- ORD record
- ord-491f53f091bf44e0a14bbf5d7eeaafbd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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