Potassium Cation → 4-(2',6'-Dimethylphenoxy)phthalonitrile
Reaction equation
[CH3:14][c:15]1[c:16]([OH:22])[c:17]([CH3:21])[cH:18][cH:19][cH:20]1.[K+:23].[K+:24].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][c:6]([C:12]#[N:13])[c:7]([C:8]#[N:9])[cH:10][cH:11]1.[O-:25][C:26]([O-:27])=[O:28].[O:29]=[CH:30][N:31]([CH3:32])[CH3:33].[OH2:34]>>[c:4]1([O:22][c:16]2[c:15]([CH3:14])[cH:20][cH:19][cH:18][c:17]2[CH3:21])[cH:5][c:6]([C:12]#[N:13])[c:7]([C:8]#[N:9])[cH:10][cH:11]1Participants
7
Sources & evidence
- ORD record
- ord-04fb963f860a4101a107ccf8b54c7a65
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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