Toluene → 5-Cyano-3-methylpyridine-2-carboxylic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][cH:10][c:11]([C:15]#[N:16])[cH:12][c:13]1[CH3:14].[CH3:17][O:18][c:19]1[cH:20][cH:21][cH:22][c:23]([O:24][CH3:25])[cH:26]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[F:27][C:28]([F:29])([F:30])[C:31]([OH:32])=[O:33]>>[O:5]=[C:6]([OH:7])[c:8]1[n:9][cH:10][c:11]([C:15]#[N:16])[cH:12][c:13]1[CH3:14]Participants
5
Sources & evidence
- ORD record
- ord-030cbd5bb6074a22b6d7f28a99399b02
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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