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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1940990Generated: November 1, 2026

Ethyl trifluoroacetate → 3-Trifluoroacetyl-3-cyanopropionaldehyde diethyl acetal

https://huagongshe.com/reaction/1940990

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl trifluoroacetateHCID 9794—
ReactantSodium hydrideHCID 24758—
Reactant4,4-DiethoxybutanenitrileHCID 87616—
SolventTetrahydrofuranHCID 8028—
Product3-Trifluoroacetyl-3-cyanopropionaldehyde diethyl acetalHCID 21459534—

Reaction Steps

Preparation of (trifluoromethyl)pyrrole carbonitriles and conversion thereof to dihalo (trifluoromethyl)pyrrole carbonitriles and dihalo- alkylated N-(trifluoromethyl)pyrrole carbonitriles can be achieved by the admixture of a dispersion of sodium hydride in tetrahydrofuran with a solution of ethyl trifluoroacetate and 3-cyano propionaldehyde diethyl acetal in tetrahydrofuran. The reaction that occurs yields 3-trifluoroacetyl-3-cyanopropionaldehyde diethyl acetal which is then heated with oxalic acid dihydrate in water to give the 3-trifluoroacetyl-3-cyanopropionaldehyde. The thus prepared aldehyde is then dissolved in glacial acetic acid and the resulting solution treated with ammonium acetate to provide the 2-(trifluoromethyl)pyrrole-3-carbonitrile. Halogenation of the above-said (trifluoromethyl)pyrrole carbonitrile may then be accomplished by reaction of said (trifluoromethyl)pyrrole carbonitrile with N-bromosuccinimide or N-chlorosuccinimide in the presence of tetrahydrofuran to yield the dihalo (trifluoromethyl)pyrrole carbonitrile. Alkylation or acylation of this dihalo (trifluoromethyl)pyrrole carbonitrile with an alkyl halide or acylhalide in the presence of potassium t-butoxide and tetrahydrofuran yields the N-alkylated (or N-acylated) dihalo (trifluoromethyl)pyrrole carbonitrile.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05702681
Source datasetuspto-grants-1997_12
ORD IDord-f4a2ff6fb6da41c28edb4d902b90d1a6
Source noteuspto-grants-1997_12