Ethyl 6-[4-(heptyloxy)phenyl]-6-oxohexanoate
[CAS# 898757-99-8]

Identification

• Name: Ethyl 6-[4-(heptyloxy)phenyl]-6-oxohexanoate
• Synonyms: ethyl 6-(4-heptyloxyphenyl)-6-oxohexanoate
• Molecular Formula: C₂₁H₃₂O₄
• Molecular Weight: 348.48
• CAS Registry Number: 898757-99-8
• SMILES: CCOC(=O)CCCCC(=O)c1ccc(OCCCCCCC)cc1
• InChI: 1S/C21H32O4/c1-3-5-6-7-10-17-25-19-15-13-18(14-16-19)20(22)11-8-9-12-21(23)24-4-2/h13-16H,3-12,17H2,1-2H3
• InChIKey: OWRXGHQKMRKSGX-UHFFFAOYSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 463.619°C at 760 mmHg (Cal.)
• Flash point: 199.141°C (Cal.)
• Refractive index: 1.49 (Cal.)