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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1463467Generated: October 25, 2026

2,6-Difluorobenzoic acid → 3-(2,6-Difluorobenzoyl)amino-epsilon-caprolactam

https://huagongshe.com/reaction/1463467

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2,6-Difluorobenzoic acidHCID 9796—
Reactant1,1'-CarbonyldiimidazoleHCID 68263—
Reactant4-Aminoazepan-2-oneHCID 21584138—
SolventTetrahydrofuranHCID 8028—
Product3-(2,6-Difluorobenzoyl)amino-epsilon-caprolactamHCID 1909038166.3%

Reaction Steps

1,1'-Carbonyldiimidazole (14.8 g), was added to a solution of 2,6-difluorobenzoic acid (12 g) in THF (200 ml) and followed by stirring for 15 mins. at room temperature. Then to the mixture was added 9.73 g of 3-amino-ε-caprolactam, and the whole was stirred for 5 hrs. at room temperature and the solvent was distilled off under reduced pressure. The residue was washed with methylenechloride to give 3-(2,6-difluorobenzoyl)amino-ε-caprolactam (13.5 g) as crude crystals. The crude crystals and phosphorus pentasulfide (8.96 g) were added to 200 ml of pyridine, and the whole was refluxed under stirring for 24 hrs. After cooling, the mixture was distilled to remove the solvent. To the residue was added a saturated sodium hydrogen carbonate solution and extracted with chloroform. The extract was washed with water, dried and concentrated under reduced pressure. The residue was purified by a column chromatography on silica gel and then recrystallized from a mixture of methylenechloride and isopropyl ether to give the title compound (3.19 g, 23.8%).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05300639
Source datasetuspto-grants-1994_04
ORD IDord-fecf849f3a324822be886dc82572877b
Source noteuspto-grants-1994_04