7-(4-Isopropoxyphenyl)-7-oxoheptanoic acid
[CAS# 898791-91-8]

Identification

• Name: 7-(4-Isopropoxyphenyl)-7-oxoheptanoic acid
• Synonyms: 7-Oxo-7-(4-isopropoxyphenyl)heptanoic acid
• Molecular Formula: C₁₆H₂₂O₄
• Molecular Weight: 278.34
• CAS Registry Number: 898791-91-8
• SMILES: CC(C)Oc1ccc(cc1)C(=O)CCCCCC(O)=O
• InChI: 1S/C16H22O4/c1-12(2)20-14-10-8-13(9-11-14)15(17)6-4-3-5-7-16(18)19/h8-12H,3-7H2,1-2H3,(H,18,19)
• InChIKey: UNBIRWQBXQPCCP-UHFFFAOYSA-N

Properties

• Density: 1.089g/cm³ (Cal.)
• Boiling point: 458.181°C at 760 mmHg (Cal.)
• Flash point: 165.626°C (Cal.)
• Refractive index: 1.513 (Cal.)