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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1443721Generated: October 30, 2026

Triethylamine → 4-[5-(2-Methoxy-phenyl)-isoxazol-3-yl]-butyric acid methyl ester

https://huagongshe.com/reaction/1443721

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTriethylamineHCID 8471—
Reactant1,4-DiisocyanatobenzeneHCID 61009—
ReactantMethyl 5-nitropentanoateHCID 543911—
Reactant1-Ethynyl-2-methoxybenzeneHCID 582912—
SolventTolueneHCID 1140—
Product4-[5-(2-Methoxy-phenyl)-isoxazol-3-yl]-butyric acid methyl esterHCID 59167784112.6%

Reaction Steps

Add 1,4-phenylenediisocyanate (19.22 g, 120.0 mmol) to a stirred solution of 1-ethynyl-2-methoxy-benzene (2204901, 5.29 g, 40.0 mmol) and 5-nitro-pentanoic acid methyl ester (7.91 g, 49.1 mmol) in toluene (300 mL, anhydrous) and stir under N2. Add triethylamine (16.7 mL, 120.0 mmol) and heat to reflux under N2 overnight. Filter mixture through a pad of Celite® and rinse with toluene. Concentrate to get 12.4 g yellow oil. Adsorb on SiO2 and purify the residue by flash chromatography on silica gel eluting with 0-30% EtOAc/hexanes to afford the title compound (14.0 g, 74%). MS (IS) 276 (M+1)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07662771B2
Source datasetuspto-grants-2010_02
ORD IDord-3439333d0c9b45aaaac5c4ab14b92823
Source noteuspto-grants-2010_02