Ibuprofen lysine

Base Information

• Chemical Name: Ibuprofen lysine
• CAS No.: 57469-77-9
• Deprecated CAS: 82240-06-0,127701-63-7
• Molecular Formula: C13H18O2^.C6H14N2O2
• Molecular Weight: 352.47
• European Community (EC) Number: 260-751-7
• UNII: N01ORX9D6S
• DSSTox Substance ID: DTXSID201024433
• Wikidata: Q27284326
• NCI Thesaurus Code: C72809
• RXCUI: 36761
• ChEMBL ID: CHEMBL1201141
• Mol file: 57469-77-9.mol

Synonyms:2-(4-isobutylphenyl)lysine propionate;Arflamin;ibuprofen lysinate;ibuprofen-Lys;ibuprofenlysinate;lysine-ibuprofen;lysine-p-isobutylphenylpropionate;Saren;solufenum

Chemical Property of Ibuprofen lysine

Chemical Property:

• Appearance/Colour: COA
• Vapor Pressure: 0.000139mmHg at 25°C
• Boiling Point: 319.6 °C at 760 mmHg
• Flash Point: 216.7 °C
• PSA: 95.41000
• LogP: 3.91530
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 352.23620751
• Heavy Atom Count: 25
• Complexity: 309

Purity/Quality:

99% ^*data from raw suppliers

IbuprofenLysinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.C(CCN)CC(C(=O)O)N
• Isomeric SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.C(CCN)C[C@@H](C(=O)O)N
• Recent ClinicalTrials: Gamma Scintigraphy Study to Investigate Tablet Disintegration in Healthy Volunteers.
• Recent EU Clinical Trials: Efficacy of a new ibuprofen formulation for vaginal application
• Uses: Anti-inflammatory (prostaglandin synthetase inhibitor). Ibuprofen Lysinate is used in the treatment of hemodynamically significant patent ductus arteriosus in neonates greater than 27 week gestational age.