3-[2-(2-Iodophenyl)-2-oxoethyl]benzonitrile
[CAS# 898784-35-5]

Identification

• Name: 3-[2-(2-Iodophenyl)-2-oxoethyl]benzonitrile
• Synonyms: 2-(3-cyanophenyl)-2'-iodoacetophenone
• Molecular Formula: C₁₅H₁₀INO
• Molecular Weight: 347.15
• CAS Registry Number: 898784-35-5
• SMILES: O=C(Cc1cccc(C#N)c1)c2ccccc2I
• InChI: 1S/C15H10INO/c16-14-7-2-1-6-13(14)15(18)9-11-4-3-5-12(8-11)10-17/h1-8H,9H2
• InChIKey: NCNUEMFKNRGOCX-UHFFFAOYSA-N

Properties

• Density: 1.657g/cm³ (Cal.)
• Boiling point: 451.116°C at 760 mmHg (Cal.)
• Flash point: 226.627°C (Cal.)
• Refractive index: 1.67 (Cal.)