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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2387097Generated: October 26, 2026

Methyl acetoacetate → 6-Cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]tetrahydropyran-2,4-dione

https://huagongshe.com/reaction/2387097

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethyl acetoacetateHCID 7757—
ReactantSodium hydrideHCID 24758—
Reactant1-Cyclopentyl-3-(2,4-dimethoxyphenyl)propan-1-oneHCID 21938618—
ReactantButyllithiumHCID 178418339—
SolventTetrahydrofuranHCID 8028—
Product6-Cyclopentyl-6-[2-(2,4-dimethoxyphenyl)ethyl]tetrahydropyran-2,4-dioneHCID 1672870058.9%

Reaction Conditions

Temperature0 °C

Reaction Steps

Methylacetoacetate (1.63 mL, 15.1 mmol) was dissolved in dry THF (42 mL) and cooled to 0° C. NaH (60% in mineral oil, 0.604 g, 15.1 mmol) were carefully added and the reaction mixture was stirred for 20 min. A solution of BuLi in hexanes (1.6 M, 9.44 mL, 15.1 mmol) was added dropwise and the resulting mixture was stirred an additional 20 min. A solution of 3-(2,4-dimethoxyphenyl)-1-cyclopentylpropan-1-one (2.33 g, 7.55 mmol) from Step 4 above in THF (37 mL) was added dropwise. After stirring 1 h, the reaction mixture was quenched with saturated aq NH4Cl (100 mL) and extracted with Et2O (600 mL). The organic phase was dried over MgSO4 and evaporated. The residue was then stirred overnight in a mixture of 0.1 M NaOH (370 mL) and THF (37 mL). After the addition of solution of 10% aqueous KHSO4 (50 mL), the resulting mixture was stirred 30 min and then extracted with Et2O (600 mL). The organic phase was washed with brine, dried over MgSO4 and evaporated. The residue was purified by flash column chromatography (50% EtOAc in hexanes) to give the product (1.54 g, 52%) as a white foam. 1H NMR (CDCl3) δ 1.43 (m, 2 H), 1.78 (m, 8 H), 2.33 (m, 1H), 2.58 (m, 2H), 2.78 (s, 2H), 3.43 (s, 2H), 3.78 (s, 6H), 6.37 (s, 1H), 6.47 (s, 1H), 6.93 (d, J=7.93 Hz, 1H). MS (APCI) calcd for C20H26O5: 346.2; found (M+1): 347.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08268835B2
Source datasetuspto-grants-2012_09
ORD IDord-4064ba34e0af4fdfac033d8fbcf23ee4
Source noteuspto-grants-2012_09