Ethyl 5-[4-(heptyloxy)phenyl]-5-oxopentanoate
[CAS# 898757-97-6]

Identification

• Name: Ethyl 5-[4-(heptyloxy)phenyl]-5-oxopentanoate
• Synonyms: ethyl 5-(4-heptyloxyphenyl)-5-oxovalerate
• Molecular Formula: C₂₀H₃₀O₄
• Molecular Weight: 334.45
• CAS Registry Number: 898757-97-6
• SMILES: CCOC(=O)CCCC(=O)c1ccc(OCCCCCCC)cc1
• InChI: 1S/C20H30O4/c1-3-5-6-7-8-16-24-18-14-12-17(13-15-18)19(21)10-9-11-20(22)23-4-2/h12-15H,3-11,16H2,1-2H3
• InChIKey: AEQIYJVQTOYNDT-UHFFFAOYSA-N

Properties

• Density: 1.013g/cm³ (Cal.)
• Boiling point: 456.577°C at 760 mmHg (Cal.)
• Flash point: 197.085°C (Cal.)
• Refractive index: 1.491 (Cal.)