2-[2-(3-Iodophenyl)-2-oxoethyl]benzonitrile
[CAS# 898784-31-1]

Identification

• Name: 2-[2-(3-Iodophenyl)-2-oxoethyl]benzonitrile
• Synonyms: 2-(2-cyanophenyl)-3'-iodoacetophenone
• Molecular Formula: C₁₅H₁₀INO
• Molecular Weight: 347.15
• CAS Registry Number: 898784-31-1
• SMILES: O=C(Cc1ccccc1C#N)c2cc(I)ccc2
• InChI: 1S/C15H10INO/c16-14-7-3-6-12(8-14)15(18)9-11-4-1-2-5-13(11)10-17/h1-8H,9H2
• InChIKey: AVZHZRYJIARRFW-UHFFFAOYSA-N

Properties

• Density: 1.657g/cm³ (Cal.)
• Boiling point: 459.168°C at 760 mmHg (Cal.)
• Flash point: 231.497°C (Cal.)
• Refractive index: 1.67 (Cal.)