3-(Cyclobutylcarbonyl)benzonitrile
[CAS# 898790-48-2]

Identification

• Name: 3-(Cyclobutylcarbonyl)benzonitrile
• Synonyms: 3-Cyanophenyl cyclobutyl ketone
• Molecular Formula: C₁₂H₁₁NO
• Molecular Weight: 185.22
• CAS Registry Number: 898790-48-2
• SMILES: O=C(c1cc(C#N)ccc1)C2CCC2
• InChI: 1S/C12H11NO/c13-8-9-3-1-6-11(7-9)12(14)10-4-2-5-10/h1,3,6-7,10H,2,4-5H2
• InChIKey: ARDHMRMXPTZBMD-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 330.002°C at 760 mmHg (Cal.)
• Flash point: 153.38°C (Cal.)
• Refractive index: 1.565 (Cal.)