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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1981282Generated: November 1, 2026

Acetic Acid → Methyl 2-cyano-3-phenylbutyrate

https://huagongshe.com/reaction/1981282

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantAcetophenoneHCID 7410—
ReactantMethyl cyanoacetateHCID 7747—
ReactantAmmonium AcetateHCID 517165—
CatalystPalladiumHCID 23938—
SolventWaterHCID 962—
SolventTolueneHCID 1140—
ProductMethyl 2-cyano-3-phenylbutyrateHCID 13276234—

Reaction Steps

A mixture of methyl cyanoacetate (198 g, 2.0 moles), acetophenone (240 g, 2.0 moles), ammonium acetate (30.8 g, 0.4 moles) and acetic acid (96 g, 1.60 moles) in toluene was refluxed with a Dean and Stark trap until water separation ceased (about 4 hours). The resulting Knoevenagel adduct was cooled and stirred under hydrogen (60 psig) with 5% palladium on carbon (8 g) for 2 days. The solution was then depressurized, degassed, filtered and evaporated. The liquid residue was distilled and the fraction with bp 110°-140° C. (about 0.03 mm) collected as mixed stereoisomers of methyl 2-cyano-3-phenylbutyrate as identified by the nmr spectrum.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS04514340
Source datasetuspto-grants-1985_04
ORD IDord-ae70ed403c8c406bafb60517d1aba782
Source noteuspto-grants-1985_04