7-(3-Chlorophenyl)-7-oxoheptanoic acid
[CAS# 898765-73-6]

Identification

• Name: 7-(3-Chlorophenyl)-7-oxoheptanoic acid
• Synonyms: 7-(3-Chlorophenyl)-7-oxoheptanoic acid
• Molecular Formula: C₁₃H₁₅ClO₃
• Molecular Weight: 254.71
• CAS Registry Number: 898765-73-6
• SMILES: O=C(CCCCCC(O)=O)c1cc(Cl)ccc1
• InChI: 1S/C13H15ClO3/c14-11-6-4-5-10(9-11)12(15)7-2-1-3-8-13(16)17/h4-6,9H,1-3,7-8H2,(H,16,17)
• InChIKey: DSZLYKHKODVGDV-UHFFFAOYSA-N

Properties

• Density: 1.212g/cm³ (Cal.)
• Boiling point: 437.147°C at 760 mmHg (Cal.)
• Flash point: 218.179°C (Cal.)
• Refractive index: 1.539 (Cal.)