Hydrochloric Acid → 4-(1-Hydroxy-4-oxocyclohexyl)benzonitrile

HRID 944032Notes

Reaction equation

HRID 944032 reaction equation
[C:31]([O:32][CH2:33][CH3:34])(=[O:35])[CH3:36].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30].[ClH:42].[Na+:24].[O-:20][C:21]([OH:22])=[O:23].[OH:1][C:2]1([c:12]2[cH:13][cH:14][c:15]([C:16]#[N:17])[cH:18][cH:19]2)[CH2:3][CH2:4][C:5]2([O:6][CH2:9][CH2:8][O:7]2)[CH2:10][CH2:11]1>>[OH:1][C:2]1([c:12]2[cH:13][cH:14][c:15]([C:16]#[N:17])[cH:18][cH:19]2)[CH2:3][CH2:4][C:5](=[O:6])[CH2:10][CH2:11]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 150239054-(8-Hydroxy-1,4-dioxaspiro[4.5]decan-8-yl)benzonitrile

Product 1

HCID 667872294-(1-Hydroxy-4-oxocyclohexyl)benzonitrile

Sources & evidence

ORD record
ord-ceee0c0c67024922912c1095ffac0db6
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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