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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1809978Generated: November 1, 2026

Celecoxib → HCID 86605546, compound

https://huagongshe.com/reaction/1809978

Reaction equation

Participants

RoleNameHCIDCharge
ReactantCelecoxibHCID 2662—
ReactantN-methyl-2-pyrrolidoneHCID 13387—
ProductHCID 86605546HCID 86605546—

Reaction Conditions

Temperature75 °C

Reaction Steps

To solid celecoxib (127 mg; 0.333 mmol) was added N-methyl-2-pyrrolidone (0.75 mL) to give a white suspension. The mixture was heated to 75 degrees C. and held at this temperature for 3 minutes at which point the solid dissolved to give a colorless solution. The solution was cooled to room temperature and then cooled to 5 degrees C. for three days. After three days, colorless hexagonal crystals had formed. The mother liquor was decanted and the solid was suspended in pentane (2 mL) and filtered. The solid was air dried and collected. The solid was found to be a 1:1 N-Methyl-2-pyrrolidone (NMP) solvate of celecoxib.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08362062B2
Source datasetuspto-grants-2013_01
ORD IDord-adf245e43a8a4cad827432e06d97e692
Source noteuspto-grants-2013_01