Ethanol → Trifluoroacetic acid
Reaction equation
[C:1]1([c:7]2[c:8]([NH:27][C:28](=[O:29])[c:30]3[n:31]([CH2:37][O:38][CH2:39][CH2:40][Si:41]([CH3:42])([CH3:43])[CH3:44])[cH:32][c:33]([C:35]#[N:36])[n:34]3)[cH:9][cH:10][c:11]([CH:13]3[CH2:14][CH2:15][N:16]([CH2:19][CH2:20][N:21]4[CH2:22][CH2:23][O:24][CH2:25][CH2:26]4)[CH2:17][CH2:18]3)[cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[CH3:55][CH2:56][OH:57].[Cl:52][CH2:53][Cl:54].[F:45][C:46]([C:47](=[O:48])[OH:49])([F:50])[F:51]>>[C:1]1([c:7]2[c:8]([NH:27][C:28](=[O:29])[c:30]3[nH:31][cH:32][c:33]([C:35]#[N:36])[n:34]3)[cH:9][cH:10][c:11]([CH:13]3[CH2:14][CH2:15][N:16]([CH2:19][CH2:20][N:21]4[CH2:22][CH2:23][O:24][CH2:25][CH2:26]4)[CH2:17][CH2:18]3)[cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[F:45][C:46]([C:47](=[O:48])[OH:49])([F:50])[F:51]Participants
6
Sources & evidence
- ORD record
- ord-03b5d221d18747c29154911750ab7f20
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…