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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2407025Generated: October 31, 2026

Toluene → 4-(4-Fluorophenyl)benzonitrile

https://huagongshe.com/reaction/2407025

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTolueneHCID 1140—
ReactantBenzonitrile, 4-bromo-HCID 12162—
Reactant4-Fluorophenylboronic acidHCID 285645—
ReactantPotassium FluorideHCID 522689—
CatalystHCID 178418397HCID 178418397—
SolventWaterHCID 962—
Product4-(4-Fluorophenyl)benzonitrileHCID 139304096.8%

Reaction Steps

To a solution of 4-bromobenzonitrile (4.0 g, 22 mmol) and 4-fluorophenylboronic acid (4.6 g, 32 mmol) in 4:1 toluene:water (100 mL) were added potassium fluoride (3.8 g, 66 mmol) and Pd(PPh3)4 (2.5 g, 2.2 mmol). The resulting mixture was stirred at reflux for 12 h. The mixture was cooled to room temperature and extracted with ethyl acetate (30 mL*3). The combined organic layers were washed with water, brine, dried over anhydrous Na2SO4 and concentrated under reduced pressure. Purification of the crude residue by silica gel chromatography gave 4′-fluorobiphenyl-4-carbonitrile (4.2 g) as a colorless solid. 1H NMR (400 MHz, CD3OD) δ 7.69 (s, 4H), 7.63-7.60 (m, 2H), 7.15-7.10 (m, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08809342B2
Source datasetuspto-grants-2014_08
ORD IDord-4cc8e04a1b8b4c8c9d54b8aeac977133
Source noteuspto-grants-2014_08