5-(2,4-Dimethylphenyl)-3-methyl-5-oxopentanoic acid
[CAS# 92864-22-7]

Identification

• Name: 5-(2,4-Dimethylphenyl)-3-methyl-5-oxopentanoic acid
• Synonyms: 5-(2,4-Dimethylphenyl)-3-methyl-5-oxovaleric acid
• Molecular Formula: C₁₄H₁₈O₃
• Molecular Weight: 234.29
• CAS Registry Number: 92864-22-7
• SMILES: O=C(CC(C)CC(O)=O)c1ccc(C)cc1C
• InChI: 1S/C14H18O3/c1-9-4-5-12(11(3)6-9)13(15)7-10(2)8-14(16)17/h4-6,10H,7-8H2,1-3H3,(H,16,17)
• InChIKey: SXQPNPJMDDUDEB-UHFFFAOYSA-N

Properties

• Density: 1.092g/cm³ (Cal.)
• Boiling point: 413.887°C at 760 mmHg (Cal.)
• Flash point: 218.264°C (Cal.)