2-Fluoro-5-(trifluoromethyl)phenol → HCID 22048961, compound
Reaction equation
[F:13][c:14]1[c:15]([CH:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][N:27]2[CH2:28][CH2:29][CH:30]([c:33]3[cH:34][c:35]([NH:39][C:40]([CH:41]([CH3:42])[CH3:43])=[O:44])[cH:36][cH:37][cH:38]3)[CH2:31][CH2:32]2)[OH:45])[cH:16][cH:17][cH:18][cH:19]1.[F:1][c:2]1[c:3]([OH:12])[cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1>>[F:1][c:2]1[c:3]([O:12][CH:20]([c:15]2[c:14]([F:13])[cH:19][cH:18][cH:17][cH:16]2)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][N:27]2[CH2:28][CH2:29][CH:30]([c:33]3[cH:34][c:35]([NH:39][C:40]([CH:41]([CH3:42])[CH3:43])=[O:44])[cH:36][cH:37][cH:38]3)[CH2:31][CH2:32]2)[cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-c405c2c7c83c436caf712ae612958acc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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