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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1922062Generated: October 26, 2026

tert-Butanol → 3-Oxo-2-(4-pyrazol-1-ylbenzyl)pentanoic acid ethyl ester

https://huagongshe.com/reaction/1922062

Reaction equation

Participants

RoleNameHCIDCharge
Reactanttert-ButanolHCID 6386—
ReactantEthyl 3-oxovalerateHCID 78656—
Reactant1-[4-(Bromomethyl)Phenyl]-1H-PyrazoleHCID 2776479—
ReactantPotassium tert-butoxideHCID 23665647—
SolventWaterHCID 962—
SolventTetrahydrofuranHCID 8028—
Product3-Oxo-2-(4-pyrazol-1-ylbenzyl)pentanoic acid ethyl esterHCID 67456360—

Reaction Conditions

Temperature0 °C

Reaction Steps

A suspension of potassium tert-butoxide (0.57 g) in tetrahydrofuran (40 mL) at 0° C. was treated with a mixture of tert-butanol (2.0 mL) and 3-oxopentanoic acid ethyl ester (0.73 mL), and the resulting mixture was stirred at 0° C. for 45 minutes. The mixture was then treated with a solution of 1-(4-bromomethylphenyl)-1H-pyrazole (1.0 g) in tetrahydrofuran (10 mL), and stirred at 0° C. for 2 hours. The mixture was diluted with water, concentrated to low bulk under reduced pressure, and the residue extracted with ethyl acetate. The combined extracts were washed with saturated aqueous sodium chloride solution, dried over magnesium sulfate and then concentrated under reduced pressure. Purification of the residue by column chromatography on silica gel, eluting with a mixture of cyclohexane and ethyl acetate gave title compound as a pale yellow oil (0.63 g).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08173812B2
Source datasetuspto-grants-2012_05
ORD IDord-17822fd00a5d4eccad77e6b59ca27202
Source noteuspto-grants-2012_05