Hydrochloric Acid → 3-Oxo-1-phenylcyclohexanecarbonitrile

HRID 102169

Reaction equation

HRID 102169 reaction equation
[C:22](=[O:23])([OH:24])[O-:25].[CH3:18][N:19]([CH3:20])[CH3:21].[ClH:17].[K:14][C:15]#[N:16].[Na+:26].[O:28]=[CH:29][N:30]([CH3:31])[CH3:32].[OH2:27].[c:1]1([C:7]2=[CH:8][C:9](=[O:13])[CH2:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2([C:15]#[N:16])[CH2:8][C:9](=[O:13])[CH2:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 1146TrimethylamineHCID 6228DimethylformamideHCID 825672-Cyclohexen-1-one, 3-phenyl-HCID 178511842HCID 178511842, compound

Product 1

HCID 123391223-Oxo-1-phenylcyclohexanecarbonitrile

Sources & evidence

ORD record
ord-333ba3f0c19f488f959f2592e5aec7f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…