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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1794245Generated: November 2, 2026

3-Fluoro-p-toluic acid → Diethyl (3-fluoro-4-methylbenzoyl)aminomalonate

https://huagongshe.com/reaction/1794245

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-Fluoro-p-toluic acidHCID 67687—
Reactant1-HydroxybenzotriazoleHCID 75771—
Reactant1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 2723939—
ReactantPropanedioic acid, 2-amino-, 1,3-diethyl ester, hydrochloride (1:1)HCID 3084143—
SolventWaterHCID 962—
SolventDimethylformamideHCID 6228—
SolventTriethylamineHCID 8471—
ProductDiethyl (3-fluoro-4-methylbenzoyl)aminomalonateHCID 3324939774%

Reaction Steps

To a solution of 10.1 g of 3-fluoro-4-methylbenzoic acid and 15.2 g of diethyl aminomalonate hydrochloride in 200 ml of N,N-dimethylformamide, 9.7 g of 1-hydroxybenzotriazole, 23 ml of triethylamine and 13.8 g of 1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride were added sequentially, and stirred for 1 hour at room temperature. After addition of water to the reaction solution, the mixture was extracted with ethyl acetate. The extract was washed with water, 10% hydrochloric acid, water, saturated aqueous sodium hydrogen carbonate solution sequentially and dried over anhydrous magnesium sulfate. The solvent was distilled off under reduced pressure and the residue was crystallized by addition of isopropyl ether to provide 15.1 g of the objective compound as colorless crystals. M.p. 102–103° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07022723B2
Source datasetuspto-grants-2006_04
ORD IDord-1c26e8bcbc4a4002b4cf76348f2ac48b
Source noteuspto-grants-2006_04