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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1908447Generated: October 28, 2026

Phosphorus pentachloride → Methyl 3-chloro-2,2-dimethylbut-3-enoate

https://huagongshe.com/reaction/1908447

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhosphorus pentachlorideHCID 24819—
ReactantMethyl 2,2-dimethylacetoacetateHCID 96925—
CatalystDimethylformamideHCID 6228—
SolventDichloromethaneHCID 6344—
ProductMethyl 3-chloro-2,2-dimethylbut-3-enoateHCID 4042347538.6%

Reaction Steps

To a suspension of PCl5 (270 g, 1.3 mol) in CH2Cl2 (1000 mL) was added dropwise methyl 2,2-dimethyl-3-oxobutanoate (85 g) at 0° C., following by addition of approximately 30 drops of dry DMF. The mixture was heated at reflux overnight. The reaction mixture was cooled to ambient temperature and slowly poured into ice water. The organic layer was separated and the aqueous phase was extracted with CH2Cl2 (500 mL×3). The combined organic layers were washed with saturated aqueous NaHCO3 and dried over anhydrous Na2SO4. The solvent was evaporated and the residue was distilled under reduced pressure to give methyl 3-chloro-2,2-dimethylbut-3-enoate (37 g, 23%). 1H NMR (400 MHz, CDCl3) δ 5.33 (s, 1H), 3.73 (s, 3H), 1.44 (s, 6H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08598181B2
Source datasetuspto-grants-2013_12
ORD IDord-41b0cd6773b44c588399f80bea5b4257
Source noteuspto-grants-2013_12