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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1715598Generated: November 1, 2026

Potassium Carbonate → 5-Fluoro-2-(3-methyl-benzo[d]isoxazol-6-yloxy)-benzonitrile

https://huagongshe.com/reaction/1715598

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPotassium CarbonateHCID 11430—
Reactant2,5-DifluorobenzonitrileHCID 123558—
Reactant3-Methyl-1,2-benzisoxazol-6-olHCID 135497890—
SolventEthyl AcetateHCID 8857—
SolventDimethylacetamideHCID 31374—
Product5-Fluoro-2-(3-methyl-benzo[d]isoxazol-6-yloxy)-benzonitrileHCID 5748411858%

Reaction Conditions

Temperature100 °C

Reaction Steps

3-Methyl-benzo[d]isoxazol-6-ol (1v) (reference for synthesis, see Indian J. Chem. Sect. B; 19:571-575 (1980)) (1.58 g, 10.6 mmol) and 2,5-difluoro-benzonitrile (2v) (1.47 g, 10.6 mmol) were combined with potassium carbonate (1.46 g. 10.6 mmol) in 15 mL of dry DMA. The reaction was heated in a 100° C. bath for 6 hours. The reaction was cooled and diluted with EtOAc (200 mL) and washed three times with water, NH4Cl, NaHCO3, and brine. The organic solution was dried over MgSO4 and concentrated. The crude residue was purified by column chromatography (silica, 70-80% CH2Cl2/hexane) to provide compound (3v) (1.65 g, 58% yield). 1H NMR (400 MHz, CDCl3) δ 7.63 (d, J=8.6 Hz, 1H), 7.44-7.41 (m, 1H), 7.33-7.26 (m, 1H), 7.10-7.06 (m, 2H), 7.03 (dd, J=8.2, 4.7 Hz, 1H), 2.59 (s, 3H); MS (ESI+) m/z 269 (M+H) detected.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07799782B2
Source datasetuspto-grants-2010_09
ORD IDord-bf6eb57fc41347e0a64b241c538e841b
Source noteuspto-grants-2010_09