Ethanol → 4-(4-Pentylbenzyloxy)-2,3-difluorobenzonitrile
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[c:6]1[cH:7][cH:8][c:9]([CH2:10][Cl:11])[cH:12][cH:13]1.[CH3:26][CH2:27][O-:28].[CH3:29][CH2:30][OH:31].[F:14][c:15]1[c:16]([OH:24])[cH:17][cH:18][c:19]([C:22]#[N:23])[c:20]1[F:21].[Na+:25]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[c:6]1[cH:7][cH:8][c:9]([CH2:10][O:24][c:16]2[c:15]([F:14])[c:20]([F:21])[c:19]([C:22]#[N:23])[cH:18][cH:17]2)[cH:12][cH:13]1Participants
6
Sources & evidence
- ORD record
- ord-5b79b8eb2e1d41b8bcdff298b2504c2b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…