Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2272286Generated: October 31, 2026

Sodium Bromide → HCID 67355236, compound

https://huagongshe.com/reaction/2272286

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium BromideHCID 253881—
ReactantPotassium FluorideHCID 522689—
ReactantCyclopropylboronic acidHCID 2760897—
ReactantHCID 86696007HCID 86696007—
CatalystHCID 178418397HCID 178418397—
SolventWaterHCID 962—
SolventTolueneHCID 1140—
SolventEthyl AcetateHCID 8857—
ProductHCID 67355236HCID 67355236—

Reaction Conditions

Temperature100 °C

Reaction Steps

Methyl 2-(4-fluorophenyl)-6-nitro-5-{[(trifluoromethyl)sulfonyl]oxy}-1-benzofuran-3-carboxylate (7.12 g, 15.37 mmol), cyclopropylboronic acid (2.19 g, 25.5 mmol), potassium fluoride (3.26 g, 56.1 mmol), sodium bromide (1.75 g, 17.01 mmol) and tetrakis(triphenylphosphine)palladium(0) (0.85 g, 0.736 mmol) were stirred together under nitrogen in a mixture of toluene (90 mL) and water (2.25 mL) and heated at 100° C. for 18 hours. The reaction mixture was cooled, diluted with ethyl acetate and washed with water. The organic phase was separated, dried by hydrophobic filter tube and evaporated under vacuum. The residue was purified by flash chromatography, eluting over silica gel with a gradient of 0-5% ethyl acetate in cyclohexane. Product containing fractions were evaporated under vacuum to give the methyl 5-cyclopropyl-2-(4-fluorophenyl)-6-nitro-1-benzofuran-3-carboxylate. LCMS (m/z, ES+)=728 (2M+NH4)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09119868B2
Source datasetuspto-grants-2015_09
ORD IDord-c684d7ca029248e9b84f079a5f82cc18
Source noteuspto-grants-2015_09