2-(Cyclobutylcarbonyl)benzonitrile
[CAS# 898790-46-0]

Identification

• Name: 2-(Cyclobutylcarbonyl)benzonitrile
• Synonyms: 2-Cyanophenyl cyclobutyl ketone; MFCD03841251
• Molecular Formula: C₁₂H₁₁NO
• Molecular Weight: 185.22
• CAS Registry Number: 898790-46-0
• SMILES: O=C(c1ccccc1C#N)C2CCC2
• InChI: 1S/C12H11NO/c13-8-10-4-1-2-7-11(10)12(14)9-5-3-6-9/h1-2,4,7,9H,3,5-6H2
• InChIKey: QLCOLIJMDKKMBC-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 345.548°C at 760 mmHg (Cal.)
• Flash point: 162.782°C (Cal.)
• Refractive index: 1.565 (Cal.)

Safety Data

• Safety Description: IRRITANT, FLAMMABLE