Pelubiprofen
[CAS# 69956-77-0]

Identification

• Name: Pelubiprofen
• Synonyms: 2-[4-[(E)-(2-Ketocyclohexylidene)Methyl]Phenyl]Propionic Acid; D01865; Pelubiprofen
• Molecular Formula: C₁₆H₁₈O₃
• Molecular Weight: 258.32
• CAS Registry Number: 69956-77-0
• SMILES: C1=CC(=CC=C1\C=C/2C(CCCC2)=O)C(C(O)=O)C
• InChI: 1S/C16H18O3/c1-11(16(18)19)13-8-6-12(7-9-13)10-14-4-2-3-5-15(14)17/h6-11H,2-5H2,1H3,(H,18,19)/b14-10+
• InChIKey: AUZUGWXLBGZUPP-GXDHUFHOSA-N

Properties

• Density: 1.199g/cm³ (Cal.)
• Boiling point: 457.358°C at 760 mmHg (Cal.)
• Flash point: 244.525°C (Cal.)