Oxaprozin glucuronide

Base Information

• Chemical Name: Oxaprozin glucuronide
• CAS No.: 90283-09-3
• Molecular Formula: C24H23 N O9
• Molecular Weight: 0
• UNII: T8OZY73W80
• DSSTox Substance ID: DTXSID80238081
• Wikidata: Q27289817
• Mol file: 90283-09-3.mol

Synonyms:oxaprozin glucuronide;oxaprozin-1-glucuronide

Chemical Property of Oxaprozin glucuronide

Chemical Property:

• Vapor Pressure: 4.95E-20mmHg at 25°C
• Boiling Point: 690.7°Cat760mmHg
• Flash Point: 371.5°C
• PSA: 159.55000
• Density: 1.51g/cm³
• LogP: 1.37660
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 8
• Exact Mass: 469.13728131
• Heavy Atom Count: 34
• Complexity: 694

Purity/Quality:

>95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)OC3C(C(C(C(O3)C(=O)O)O)O)O)C4=CC=CC=C4
• Isomeric SMILES: C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)C4=CC=CC=C4
• Uses: Oxaprozin Glucuronide is an impurity of Oxaprozin(O845400), which is an anti-inflammatory drug. Oxaprozin was comparable to Aspirin (A687780).