8-(2,5-Dimethylphenyl)-8-oxooctanoic acid
[CAS# 898788-01-7]

Identification

• Name: 8-(2,5-Dimethylphenyl)-8-oxooctanoic acid
• Synonyms: 8-(2,5-dimethylphenyl)-8-oxooctanoic acid
• Molecular Formula: C₁₆H₂₂O₃
• Molecular Weight: 262.34
• CAS Registry Number: 898788-01-7
• SMILES: O=C(CCCCCCC(O)=O)c1cc(C)ccc1C
• InChI: 1S/C16H22O3/c1-12-9-10-13(2)14(11-12)15(17)7-5-3-4-6-8-16(18)19/h9-11H,3-8H2,1-2H3,(H,18,19)
• InChIKey: ZEGRXWUJHVOUFQ-UHFFFAOYSA-N

Properties

• Density: 1.061g/cm³ (Cal.)
• Boiling point: 437.964°C at 760 mmHg (Cal.)
• Flash point: 232.809°C (Cal.)
• Refractive index: 1.521 (Cal.)