2-[4-(3-Methyl-3-Pentanyl)Phenyl]Propanoic Acid
[CAS# 3585-54-4]

Identification

• Name: 2-[4-(3-Methyl-3-Pentanyl)Phenyl]Propanoic Acid
• Synonyms: 2-(4-(3-methylpentan-3-yl)phenyl)propanoic acid
• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.33
• CAS Registry Number: 3585-54-4
• SMILES: CCC(C)(CC)c1ccc(cc1)C(C)C(=O)O
• InChI: 1S/C15H22O2/c1-5-15(4,6-2)13-9-7-12(8-10-13)11(3)14(16)17/h7-11H,5-6H2,1-4H3,(H,16,17)
• InChIKey: XLLBPUCAXKLRTO-UHFFFAOYSA-N

Properties

• Density: 1.002g/cm³ (Cal.)
• Boiling point: 343.038°C at 760 mmHg (Cal.)
• Flash point: 240.023°C (Cal.)