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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 451093Generated: October 30, 2026

Isocyanatocarbonyl chloride → HCID 58075534, compound

https://huagongshe.com/reaction/451093

Reaction equation

Participants

RoleNameHCIDCharge
ReactantIsocyanatocarbonyl chlorideHCID 119708—
ReactantHCID 58075506HCID 58075506—
SolventEthyl AcetateHCID 8857—
ProductHCID 58075534HCID 5807553446.4%

Reaction Conditions

Temperature130 °C

Reaction Steps

A mixture of 2-(3,4,5-trifluorophenyl)cyclopentanone (2 g, 9.34 mmol) and carbonisocyanatidic chloride (1.773 g, 16.81 mmol) was heated at 58° C. for 1 h and at 130° C. for 2 h. Upon cooling to room temperature, the reaction mixture was dissolved in ethyl acetate and washed with saturated aqueous solution of sodium bicarbonate. The organic layer was separated and the aqueous layer was extracted with ethyl acetate. The combined organic extracts were dried over anhydrous magnesium sulfate and filtered. The solvent was removed in vacuum and the residue was purified by column chromatography on silica gel to give 7-(3,4,5-trifluorophenyl)-6,7-dihydrocyclopenta[e][1,3]oxazine-2,4(3H,5H)-dione (1.227 g, 4.33 mmol, 46.4% yield). LC-MS (M+H)+=284.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08486952B2
Source datasetuspto-grants-2013_07
ORD IDord-2a40cbe0a3624690934142793d40b465
Source noteuspto-grants-2013_07