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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 475668Generated: October 29, 2026

Water → 3'-Fluoro-4'-methylbiphenyl-2-carboxylic acid t-butyl ester

https://huagongshe.com/reaction/475668

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantIsopropanolHCID 3776—
ReactantSodium CarbonateHCID 10340—
Reactant3-Fluoro-4-methylbenzeneboronic acidHCID 2782674—
Reactanttert-Butyl 2-bromobenzoateHCID 3804415—
CatalystHCID 178418397HCID 178418397—
Product3'-Fluoro-4'-methylbiphenyl-2-carboxylic acid t-butyl esterHCID 5748394076.6%

Reaction Conditions

Temperature90 °C

Reaction Steps

Compound A (80.0 g, 311 mmol) and 3-fluoro-4-methylphenylboronic acid (52.7 g, 342 mmol) were suspended in isopropyl alcohol (260 mL, 3.5 mol). A solution of sodium carbonate (56.1 g, 529 mmol) in water (260 mL, 15 mol) was added and the mixture was degassed under nitrogen. Tetrakis(triphenylphosphine)palladium(0) (3.6 g, 3.1 mmol) was then added and the mixture was stirred at 90° C. for 17 hours. The mixture was concentrated under reduced pressure and suspended in water (200 mL). The aqueous phase was extracted with EtOAc (600 mL) and separated. The organic phase was washed with saturated aqueous NaCl and concentrated under reduced pressure. The recovered oil was purified by silica gel chromatography (4-6% 5×120 g column) to yield compound B as a clear oil (68.2 g).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08637562B2
Source datasetuspto-grants-2014_01
ORD IDord-42eba26a4feb4aff94b1503ef8fed07e
Source noteuspto-grants-2014_01