Ethyl 8-(3-iodophenyl)-8-oxooctanoate
[CAS# 898777-36-1]

Identification

• Name: Ethyl 8-(3-iodophenyl)-8-oxooctanoate
• Synonyms: Ethyl 8-(3-iodophenyl)-8-oxooctanoate
• Molecular Formula: C₁₆H₂₁IO₃
• Molecular Weight: 388.24
• CAS Registry Number: 898777-36-1
• SMILES: O=C(CCCCCCC(=O)OCC)c1cc(I)ccc1
• InChI: 1S/C16H21IO3/c1-2-20-16(19)11-6-4-3-5-10-15(18)13-8-7-9-14(17)12-13/h7-9,12H,2-6,10-11H2,1H3
• InChIKey: QAAFROJXIUATIC-UHFFFAOYSA-N

Properties

• Density: 1.394g/cm³ (Cal.)
• Boiling point: 438.762°C at 760 mmHg (Cal.)
• Flash point: 219.156°C (Cal.)
• Refractive index: 1.544 (Cal.)