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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1523220Generated: November 4, 2026

Acetonitrile → 3-(3-((4,4-Difluorocyclohexyl)methoxy)phenyl)-3-hydroxypropanenitrile

https://huagongshe.com/reaction/1523220

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantAmmonium ChlorideHCID 25517—
ReactantPotassium tert-butoxideHCID 23665647—
Reactant3-((4,4-Difluorocyclohexyl)methoxy)benzaldehydeHCID 58027701—
SolventTetrahydrofuranHCID 8028—
SolventEthyl AcetateHCID 8857—
Product3-(3-((4,4-Difluorocyclohexyl)methoxy)phenyl)-3-hydroxypropanenitrileHCID 58027620—

Reaction Conditions

Temperature0 °C

Reaction Steps

Potassium t-butoxide (2.59 mmole, 2.6 ml of a 1.0M solution in THF) was cooled to −50° C. Acetonitrile (0.106 g, 2.59 mmole) was slowly added and stirred for 15 min. Benzaldehyde 143 (0.55 g, 2.16 mmole) in THF (1.0 ml) was added and the reaction was allowed to warm to 0° C. over 30 min. Sat. NH4Cl (20 ml) and EtOAc (30 ml) was added and stirred for 10 min. The organic layer was dried over Na2SO4 and evaporated giving 3-(3-((4,4-difluorocyclohexyl)methoxy)phenyl)-3-hydroxypropanenitrile (144) as an oil. Yield (0.622 g, 97%): 1H NMR (400 MHz, DMSO-d6) δ 7.22 (t, J=7.8 Hz, 1H), 6.96-6.93 (m, 2H), 6.82 (ddd, J=8.2, 2.6, 0.8 Hz, 1H), 5.89 (d, J=4.8 Hz, 2H), 4.85-4.81 (m, 1H), 2.86 (ABd, J=16.4, 5.0 Hz, 1H), 2.77 (ABd, J=16.8, 6.8 Hz, 1H), 2.04-1.96 (m, 2H), 1.88-1.73 (m, 5H), 1.35-1.25 (m, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09079825B2
Source datasetuspto-grants-2015_07
ORD IDord-e16ced4527c74c83a9c4b3bdfe32c7ab
Source noteuspto-grants-2015_07