Hydrochloric Acid → 2-(4-Chloro-2,6-dimethylphenyl)-3-oxobutanenitrile
Reaction equation
[CH3:15][CH2:16][O:17][C:18]([CH3:19])=[O:20].[Cl:1][c:2]1[cH:3][c:4]([CH3:12])[c:5]([CH2:9][C:10]#[N:11])[c:6]([CH3:8])[cH:7]1.[ClH:14].[Na:13]>>[Cl:1][c:2]1[cH:3][c:4]([CH3:12])[c:5]([CH:9]([C:10]#[N:11])[C:16]([CH3:15])=[O:17])[c:6]([CH3:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-0ce161ad95d4498c9c10a05c304b1a7a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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