4-[2-(4-Iodophenyl)-2-oxoethyl]benzonitrile
[CAS# 898784-43-5]

Identification

• Name: 4-[2-(4-Iodophenyl)-2-oxoethyl]benzonitrile
• Synonyms: 2-(4-cyanophenyl)-4'-iodoacetophenone; MFCD02260746
• Molecular Formula: C₁₅H₁₀INO
• Molecular Weight: 347.15
• CAS Registry Number: 898784-43-5
• SMILES: O=C(Cc1ccc(C#N)cc1)c2ccc(I)cc2
• InChI: 1S/C15H10INO/c16-14-7-5-13(6-8-14)15(18)9-11-1-3-12(10-17)4-2-11/h1-8H,9H2
• InChIKey: FCMOEXPCHJZSIG-UHFFFAOYSA-N

Properties

• Density: 1.657g/cm³ (Cal.)
• Boiling point: 470.268°C at 760 mmHg (Cal.)
• Flash point: 238.21°C (Cal.)
• Refractive index: 1.67 (Cal.)

Safety Data

• Safety Description: IRRITANT, FLAMMABLE