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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1519442Generated: November 4, 2026

Sodium Carbonate → 3-Fluoro-5-methoxy-[1,1'-biphenyl]-4-carbonitrile

https://huagongshe.com/reaction/1519442

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium CarbonateHCID 10340—
ReactantPhenylboronic AcidHCID 66827—
Reactant4-Bromo-2-fluoro-6-methoxybenzonitrileHCID 57442209—
CatalystEthanolHCID 702—
SolventTolueneHCID 1140—
SolventEthyl AcetateHCID 8857—
Product3-Fluoro-5-methoxy-[1,1'-biphenyl]-4-carbonitrileHCID 8671935497.9%

Reaction Conditions

Temperature80 °C

Reaction Steps

A mixture of 4-bromo-2-fluoro-6-methoxybenzonitrile (2, 5.22 g, 22.7 mmol), phenylboronic acid (4.15 g, 34 mmol) and 2 M Na2CO3 (23 mL) in toluene (100 mL) was purged with N2 for 10 min. Pd(PPh4)3 (2.62 g, 27.7 mmol) and EtOH (5 drops) were added. The mixture was then heated under N2 in a sealed tube at 80° C. for 18 h. The mixture was cooled to room temperature, diluted with EtOAc (300 mL), filtered through celite, concentrated and purified by silica gel chromatography eluting with ethyl acetate in hexane (0-100%) to afford the title compound (5.05 g, 97%) as a white solid: 1H NMR (500 MHz, CDCl3) δ 7.57-7.55 (m, 2H), 7.50-7.23 (m, 3H), 7.01-6.99 (m, 1H), 6.93 (s, 1H), 3.95 (s, 3H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09073878B2
Source datasetuspto-grants-2015_07
ORD IDord-79afc8bed5b64de4a6a0474dd93b250d
Source noteuspto-grants-2015_07