Sodium 4-Oxo-4-(4-Phenylphenyl)Butanoate
[CAS# 77479-09-5]

Identification

• Name: Sodium 4-Oxo-4-(4-Phenylphenyl)Butanoate
• Synonyms: Sodium 4-Keto-4-(4-Phenylphenyl)Butyrate; (1,1'-Biphenyl)-4-Butanoic Acid, Gamma-Oxo-, Sodium Salt
• Molecular Formula: C₁₆H₁₃NaO₃
• Molecular Weight: 276.27
• CAS Registry Number: 77479-09-5
• SMILES: C2=C(C1=CC=CC=C1)C=CC(=C2)C(CCC([O-])=O)=O.[Na+]
• InChI: 1S/C16H14O3.Na/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12;/h1-9H,10-11H2,(H,18,19);/q;+1/p-1
• InChIKey: XVQJIQGMWDJLSO-UHFFFAOYSA-M

Properties

• Boiling point: 470.2°C at 760 mmHg (Cal.)
• Flash point: 252.3°C (Cal.)