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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1877656Generated: October 29, 2026

Quinone → Ethyl 2-(4-fluorophenyl)-5-hydroxy-1-benzofuran-3-carboxylate

https://huagongshe.com/reaction/1877656

Reaction equation

Participants

RoleNameHCIDCharge
ReactantQuinoneHCID 4650—
ReactantEthyl AcetateHCID 8857—
ReactantEthyl 3-(4-Fluorophenyl)-3-OxopropanoateHCID 2758844—
CatalystZincchlorideHCID 3007855—
SolventTolueneHCID 1140—
ProductEthyl 2-(4-fluorophenyl)-5-hydroxy-1-benzofuran-3-carboxylateHCID 56604952—

Reaction Conditions

Temperature70 °C

Reaction Steps

To a stirred solution of zinc chloride (8.39 g, 1.14 mmol, 1 eq) in toluene at ambient temperature, ethyl 3-(4-fluorophenyl)-3-oxopropanoate (13 g, 2.74 mmol, 1 eq) was added and stirred at 70° C. for 15 min. Benzoquinone (6.66 g, 0.72 mmol, 1 eq) was added portion wise into the reaction mixture and stirred at the same temperature for 15-20 min. Dean-stark apparatus was assembled and the reaction mixture was heated at 140° C. for 12 h and cooled to ambient temperature. Reaction completion was judged by TLC. EtOAc was added to the reaction mass and filtered through the filter paper, to remove the inorganic material. Brine was added to the reaction mixture (filtrate) and extracted, dried over sodium sulphate and concentrated to get the crude material. Further it was purified by column chromatography using 10% EtOAc/Hexane system. Yield: 8.0 g (43%). 1H NMR (400 MHz, CDCl3): δ 1.38-1.42 (t, 3H, J=7.14 Hz), 4.37-4.42 (q, 2H, J=7.13 Hz), 5.2 (br s, 1H), 6.87-6.9 (q, 1H, J=3.81 Hz), 7.14-7.18 (q, 2H, J=5.82 Hz), 7.36-7.39 (d, 1H, J=8.80 Hz), 7.50-7.51 (d, 1H, J=2.56 Hz), 8.00-8.03 (m, 2H). LCMS: (ES+) m/z=301 (M+H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08309558B2
Source datasetuspto-grants-2012_11
ORD IDord-1bef9b217ff74435a9f92020a7bc0e50
Source noteuspto-grants-2012_11