3-[2-(3-Iodophenyl)-2-oxoethyl]benzonitrile
[CAS# 898784-37-7]

Identification

• Name: 3-[2-(3-Iodophenyl)-2-oxoethyl]benzonitrile
• Synonyms: 2-(3-cyanophenyl)-3'-iodoacetophenone
• Molecular Formula: C₁₅H₁₀INO
• Molecular Weight: 347.15
• CAS Registry Number: 898784-37-7
• SMILES: O=C(Cc1cccc(C#N)c1)c2cc(I)ccc2
• InChI: 1S/C15H10INO/c16-14-6-2-5-13(9-14)15(18)8-11-3-1-4-12(7-11)10-17/h1-7,9H,8H2
• InChIKey: XIWIMEBDPZDOKP-UHFFFAOYSA-N

Properties

• Density: 1.657g/cm³ (Cal.)
• Boiling point: 464.662°C at 760 mmHg (Cal.)
• Flash point: 234.82°C (Cal.)
• Refractive index: 1.67 (Cal.)