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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 74003Generated: October 25, 2026

Water → 2-Tert-butyl-4-(2-ethoxyphenyl)-5-nitrophenol

https://huagongshe.com/reaction/74003

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPotassium CarbonateHCID 11430—
Reactant(2-Ethoxyphenyl)boronic acidHCID 2734902—
Reactant2-Tert-butyl-4-bromo-5-nitrophenolHCID 57470236—
CatalystHCID 178418397HCID 178418397—
SolventDimethylformamideHCID 6228—
Product2-Tert-butyl-4-(2-ethoxyphenyl)-5-nitrophenolHCID 5747024097.2%

Reaction Conditions

Temperature90 °C

Reaction Steps

To a solution of 2-tert-butyl-4-bromo-5-nitrophenol (C-14-a) (8.22 g, 30 mmol) in DMF (90 mL) was added 2-ethoxyphenyl boronic acid (5.48 g, 33 mmol), potassium carbonate (4.56 g, 33 mmol), water (10 ml) and Pd(PPh3)4 (1.73 g, 1.5 mmol). The mixture was heated at 90° C. for 3 h under nitrogen. The solvent was removed under reduced pressure. The residue was partitioned between water and ethyl acetate. The combined organic layers were washed with water and brine, dried and purified by column chromatography (petroleum ether-ethyl acetate, 10:1) to afford 2-tert-butyl-4-(2-ethoxyphenyl)-5-nitrophenol (9.2 g, 92%). 1H NMR (DMSO-d6) δ 10.38 (s, 1H), 7.36 (s, 1H), 7.28 (m, 2H), 7.08 (s, 1H), 6.99 (t, 1H, J=7.35 Hz), 6.92 (d, 1H, J=8.1 Hz), 3.84 (q, 2H, J=6.6 Hz), 1.35 (s, 9H), 1.09 (t, 3H, J=6.6 Hz); ESI-MS 314.3 m/z (MH+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08829204B2
Source datasetuspto-grants-2014_09
ORD IDord-6cb6e0d7921243efbb85a3795c2e1928
Source noteuspto-grants-2014_09