Ethanol → Trifluoroacetic acid
Reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][C:8]([CH2:9][C:10](=[O:11])[N:12]1[CH2:13][CH2:14][CH:15]([c:18]2[cH:19][c:20]([C:34]3=[CH:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[c:21]([NH:24][C:25](=[O:26])[c:27]3[nH:28][cH:29][c:30]([C:32]#[N:33])[n:31]3)[cH:22][cH:23]2)[CH2:16][CH2:17]1)([CH3:40])[CH3:41])([CH3:5])([CH3:6])[CH3:42].[CH3:43][CH2:44][OH:45].[Cl:53][CH2:54][Cl:55].[F:46][C:47]([C:48](=[O:49])[OH:50])([F:51])[F:52]>>[F:46][C:47]([C:48](=[O:49])[OH:50])([F:51])[F:52].[NH2:7][C:8]([CH2:9][C:10](=[O:11])[N:12]1[CH2:13][CH2:14][CH:15]([c:18]2[cH:19][c:20]([C:34]3=[CH:35][CH2:36][CH2:37][CH2:38][CH2:39]3)[c:21]([NH:24][C:25](=[O:26])[c:27]3[nH:28][cH:29][c:30]([C:32]#[N:33])[n:31]3)[cH:22][cH:23]2)[CH2:16][CH2:17]1)([CH3:40])[CH3:41]Participants
6
Sources & evidence
- ORD record
- ord-4bb0e0c604464d13aa00b52369139471
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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