3-Methyl-2-Phenylhexanoic Acid
[CAS# 26878-40-0]

Identification

• Name: 3-Methyl-2-Phenylhexanoic Acid
• Synonyms: 3-Methyl-2-Phenyl-Hexanoic Acid; Nsc165842
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 26878-40-0
• SMILES: C1=CC=CC=C1C(C(CCC)C)C(O)=O
• InChI: 1S/C13H18O2/c1-3-7-10(2)12(13(14)15)11-8-5-4-6-9-11/h4-6,8-10,12H,3,7H2,1-2H3,(H,14,15)
• InChIKey: YUNSFLRLJVSMKM-UHFFFAOYSA-N

Properties

• Density: 1.029g/cm³ (Cal.)
• Boiling point: 314.323°C at 760 mmHg (Cal.)
• Flash point: 211.4°C (Cal.)