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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2172377Generated: October 31, 2026

4-Chloro-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester → HCID 86676021, compound

https://huagongshe.com/reaction/2172377

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-Chloro-2-(methylthio)pyrimidine-5-carboxylic acid ethyl esterHCID 80008—
ReactantPotassium FluorideHCID 522689—
ReactantStannane, tributyl(1-ethoxyethenyl)-HCID 619414—
CatalystHCID 178418476HCID 178418476—
SolventWaterHCID 962—
SolventDiethyl EtherHCID 3283—
SolventDimethylformamideHCID 6228—
ProductHCID 86676021HCID 86676021—

Reaction Steps

A solution of ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate (3.0 g, 12.89 mmol), tributyl(1-ethoxyvinyl)stannane (4.79 ml, 14.18 mmol) and bis(triphenylphosphine)palladium dichloride (0.452 g, 0.645 mmol) in N,N-dimethylformamide (43 mL) was heated to 70° C. for 1 hour. The mixture was cooled, treated with a solution of KF (1.5 g in 3 mL water) and stirred overnight at room temperature. The mixture was diluted with water and ether and filtered through diatomaceous earth. The layers were separated and the aqueous layer was extracted into ether. The combined extracts were rinsed with brine, dried over MgSO4, filtered, and concentrated under reduced pressure. The residue was purified by flash chromatography (0-20% gradient ethyl acetate in hexane) to provide the title compound. MS ESI(+) m/z 269.0 [M+H]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09051327B2
Source datasetuspto-grants-2015_06
ORD IDord-657b530e163b4d84b8bbc4b9e8abb5de
Source noteuspto-grants-2015_06