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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1466596Generated: October 30, 2026

Pivalic acid → HCID 66863438, compound

https://huagongshe.com/reaction/1466596

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPivalic acidHCID 6417—
ReactantPotassium CarbonateHCID 11430—
Reactant2-Bromo-4-chloroanisoleHCID 521935—
ReactantHCID 66847207HCID 66847207—
Catalystpalladium(II) acetateHCID 167845—
SolventEthyl AcetateHCID 8857—
SolventDimethylacetamideHCID 31374—
ProductHCID 66863438HCID 66863438—

Reaction Conditions

Temperature120 °C

Reaction Steps

A mixture of 1-Isopentyl-4-nitro-1H-pyrazole (356.9 mg, 1.95 mmol, 1.00 eq), 2-Bromo-4-chloroanisole (0.37 ml, 2.72 mmol, 1.40 eq), Palladium (II) acetate (88 mg, 0.39 mmol, 0.20 eq), Di(1-adanmtyl)-n-butylphosphine (209 mg, 0.58 mmol, 0.30 eq), potassium carbonate (807 mg, 5.84 mmol, 3.00 eq) and trimethylacetic acid (52 mg, 0.50 mmol, 0.26 eq) in 5.0 mL N,N-Dimethylacetamide was stirred at 120° C. for 12 hours. The reaction mixture was cooled to room temperature and diluted with 20 mL ethyl acetate and filtered. The filtrate was then concentrated and used as is for the next step. LCMS (ESI) m+H=324.3

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08999998B2
Source datasetuspto-grants-2015_04
ORD IDord-57fb71f4efb94be6811d9b660e9a64a7
Source noteuspto-grants-2015_04