3-Methyl-5-Oxo-5-(3,4,5-Trimethoxyphenyl)Pentanoic Acid
[CAS# 101499-91-6]

Identification

• Name: 3-Methyl-5-Oxo-5-(3,4,5-Trimethoxyphenyl)Pentanoic Acid
• Synonyms: 3-Methyl-5-oxo-5-(3,4,5-trimethoxyphenyl)valeric acid
• Molecular Formula: C₁₅H₂₀O₆
• Molecular Weight: 296.32
• CAS Registry Number: 101499-91-6
• SMILES: COc1c(cc(cc1OC)C(=O)CC(C)CC(O)=O)OC
• InChI: 1S/C15H20O6/c1-9(6-14(17)18)5-11(16)10-7-12(19-2)15(21-4)13(8-10)20-3/h7-9H,5-6H2,1-4H3,(H,17,18)
• InChIKey: SLJQUNAKJDHQTQ-UHFFFAOYSA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 471.729°C at 760 mmHg (Cal.)
• Flash point: 171.99°C (Cal.)
• Refractive index: 1.513 (Cal.)