5-(3-Fluorophenyl)-5-oxopentanenitrile
[CAS# 898767-18-5]

Identification

• Name: 5-(3-Fluorophenyl)-5-oxopentanenitrile
• Synonyms: 5-(3-fluorophenyl)-5-oxovaleronitrile
• Molecular Formula: C₁₁H₁₀FNO
• Molecular Weight: 191.20
• CAS Registry Number: 898767-18-5
• SMILES: O=C(CCCC#N)c1cc(F)ccc1
• InChI: 1S/C11H10FNO/c12-10-5-3-4-9(8-10)11(14)6-1-2-7-13/h3-5,8H,1-2,6H2
• InChIKey: RUQCPSKGUVMJBF-UHFFFAOYSA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 348.889°C at 760 mmHg (Cal.)
• Flash point: 164.803°C (Cal.)
• Refractive index: 1.507 (Cal.)