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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 74428Generated: October 29, 2026

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

https://huagongshe.com/reaction/74428

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 numberUS08829244B2
Source datasetuspto-grants-2014_09
ORD IDord-ce72cd171798477ba39c4182de463845
Source noteuspto-grants-2014_09