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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 892066Generated: October 26, 2026

Acetonitrile → 3-Oxo4-m-tolyl-butyronitrile

https://huagongshe.com/reaction/892066

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantSodium HydroxideHCID 14798—
ReactantEthyl m-tolylacetateHCID 96574—
ReactantButyllithiumHCID 178418339—
SolventTetrahydrofuranHCID 8028—
Product3-Oxo4-m-tolyl-butyronitrileHCID 22241672—

Reaction Conditions

Temperature-78 °C

Reaction Steps

Under Ar(g), a solution of anhydrous acetonitrile (1.5 mL) in 35 mL anhydrous THF is cooled to −78° C. in a dry ice-acetone bath and then slowly treated with 11 mL of a 2.5 M n-butyl lithium in hexanes. The reaction mixture is maintained at −78° C. for an additional 45 min. and then slowly treated with a solution of 5 gms. of m-tolyl-acetic acid ethyl ester in 5 mL of anhydrous THF. The resulting solution is then stirred overnight at room temperature. Subsequently, the reaction mixture is treated with 10% NaOH(aq) to dissolve solids and then extracted with ethyl acetate. The aqueous layer is acidified (pH 6) with HCl(aq) affording a white precipitate which subsequently is filtered. The organic layer is concentrated in vacuo, and the residue is triturated with isopropanol resulting in the formation of additional white precipitate. The combined precipitates provide the desired 3-oxo-4-m-tolyl-butyronitrile in the amount of 2.5463 gms.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07005444B2
Source datasetuspto-grants-2006_02
ORD IDord-7c90a7f296884803acd6978fbe53ad12
Source noteuspto-grants-2006_02