5-(3,5-Dimethoxyphenyl)-5-oxopentanoic acid
[CAS# 898792-55-7]

Identification

• Name: 5-(3,5-Dimethoxyphenyl)-5-oxopentanoic acid
• Synonyms: 5-(3,5-Dimethoxyphenyl)-5-oxovaleric acid
• Molecular Formula: C₁₃H₁₆O₅
• Molecular Weight: 252.26
• CAS Registry Number: 898792-55-7
• SMILES: COc1cc(cc(OC)c1)C(=O)CCCC(O)=O
• InChI: 1S/C13H16O5/c1-17-10-6-9(7-11(8-10)18-2)12(14)4-3-5-13(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)
• InChIKey: GWWBYOZFGUNDBP-UHFFFAOYSA-N

Properties

• Density: 1.184g/cm³ (Cal.)
• Boiling point: 444.539°C at 760 mmHg (Cal.)
• Flash point: 168.96°C (Cal.)
• Refractive index: 1.522 (Cal.)