5-Oxo-5-(pentamethylphenyl)pentanoic acid
[CAS# 655224-28-5]

Identification

• Name: 5-Oxo-5-(pentamethylphenyl)pentanoic acid
• Synonyms: 5-(2,3,4,5,6-Pentamethylphenyl)-5-oxovaleric acid; Maybridge3_000894
• Molecular Formula: C₁₆H₂₂O₃
• Molecular Weight: 262.34
• CAS Registry Number: 655224-28-5
• SMILES: O=C(O)CCCC(=O)c1c(c(c(c(c1C)C)C)C)C
• InChI: 1S/C16H22O3/c1-9-10(2)12(4)16(13(5)11(9)3)14(17)7-6-8-15(18)19/h6-8H2,1-5H3,(H,18,19)
• InChIKey: LSTWOJFKZVADSB-UHFFFAOYSA-N

Properties

• Density: 1.064g/cm³ (Cal.)
• Boiling point: 459.193°C at 760 mmHg (Cal.)
• Flash point: 245.633°C (Cal.)
• Refractive index: 1.528 (Cal.)