6-(3-Iodophenyl)-6-oxohexanoic acid
[CAS# 898790-86-8]

Identification

• Name: 6-(3-Iodophenyl)-6-oxohexanoic acid
• Synonyms: 6-(3-iodophenyl)-6-oxohexanoic acid
• Molecular Formula: C₁₂H₁₃IO₃
• Molecular Weight: 332.13
• CAS Registry Number: 898790-86-8
• SMILES: O=C(CCCCC(O)=O)c1cc(I)ccc1
• InChI: 1S/C12H13IO3/c13-10-5-3-4-9(8-10)11(14)6-1-2-7-12(15)16/h3-5,8H,1-2,6-7H2,(H,15,16)
• InChIKey: WYUJKKRJIGVNEB-UHFFFAOYSA-N

Properties

• Density: 1.631g/cm³ (Cal.)
• Boiling point: 466.237°C at 760 mmHg (Cal.)
• Flash point: 235.772°C (Cal.)
• Refractive index: 1.595 (Cal.)