Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1983465Generated: October 31, 2026

Water → 1,1-Dimethylethyl 3-(3-fluorophenyl)-5-nitro-1H-indazole-1-carboxylate

https://huagongshe.com/reaction/1983465

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPotassium FluorideHCID 522689—
Reactant1-Boc-3-bromo-5-nitro-1H-indazoleHCID 22260836—
Catalystpalladium(II) acetateHCID 167845—
Catalyst2-(Di-tert-butylphosphino)biphenylHCID 2734215—
SolventDimethylformamideHCID 6228—
Product1,1-Dimethylethyl 3-(3-fluorophenyl)-5-nitro-1H-indazole-1-carboxylateHCID 2226087993.6%

Reaction Conditions

Temperature50 °C

Reaction Steps

To a solution of 4.5 g of tert-butyl 3-bromo-5-nitro-1H-1-indazolecarboxylate in 20 ml N,N-dimethylformamide were added 2.8 g of 3-fluorophenylboronic aid, 0.16 g of 2-(di-tert-butylphosphino)biphenyl, 60 mg of palladium acetate and 2.31 g of potassium fluoride, and the mixture was heated at 50° C. for two days. To the reaction mixture was added water and the mixture was extracted with ethyl acetate. The organic layer was washed with water, dried over anhydrous magnesium sulfate and the solvent was evaporated. The residue was purified and separated by silica gel column chromatography (ethyl acetate:hexane=1:15), and then recrystallized from diisopropyl ether-hexane, to give 2.2 g of the title compound as a colorless powder.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07541376B2
Source datasetuspto-grants-2009_06
ORD IDord-b5cb72ff3c994d829e918bba9cac9fbe
Source noteuspto-grants-2009_06