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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2091750Generated: November 1, 2026

Ethyl Acetate → 5-(4-Trifluoromethoxy-phenyl)-nicotinic acid methyl ester

https://huagongshe.com/reaction/2091750

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl AcetateHCID 8857—
ReactantPotassium FluorideHCID 522689—
ReactantMethyl 5-bromopyridine-3-carboxylateHCID 699336—
Reactant4-(Trifluoromethoxy)phenylboronic acidHCID 2734386—
CatalystHCID 178418397HCID 178418397—
SolventEthanolHCID 702—
SolventWaterHCID 962—
SolventTolueneHCID 1140—
Product5-(4-Trifluoromethoxy-phenyl)-nicotinic acid methyl esterHCID 58002591—

Reaction Steps

A solution of 26 g (121 mmol) of methyl 5-bromonicotinate in toluene (220 ml) was admixed under argon at RT with 2.8 g (2.4 mmol) of tetrakis(triphenylphosphine)palladium, and then a solution of 30 g (146 mmol) of 4-trifluoromethoxyphenylboronic acid in ethanol (58 ml) was added. After adding 14 g (243 mmol) of potassium fluoride in water (58 ml), the mixture was stirred under reflux overnight, a further 0.70 g (0.61 mmol) of tetrakis(triphenylphosphine)palladium was added, and the mixture was stirred under reflux for a further 24 h. After adding another 1.4 g (1.2 mmol) of tetrakis(triphenylphosphine)palladium, the mixture was stirred under reflux for 20 h, and the reaction solution was admixed with ethyl acetate and washed with water and saturated aqueous sodium chloride solution. The organic phase was dried over magnesium sulphate, filtered and concentrated under reduced pressure. The residue was purified by means of column chromatography (silica gel, cyclohexane/dichloromethane 1:1→dichloromethane). Yield: 31 g (86% of theory)

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08440657B2
Source datasetuspto-grants-2013_05
ORD IDord-5d0ac045a7594f65b49e9575c6dc5f77
Source noteuspto-grants-2013_05