5-(3-Chlorophenyl)-5-oxopentanenitrile
[CAS# 898767-68-5]

Identification

• Name: 5-(3-Chlorophenyl)-5-oxopentanenitrile
• Synonyms: 5-(3-chlorophenyl)-5-oxovaleronitrile
• Molecular Formula: C₁₁H₁₀ClNO
• Molecular Weight: 207.66
• CAS Registry Number: 898767-68-5
• SMILES: O=C(CCCC#N)c1cc(Cl)ccc1
• InChI: 1S/C11H10ClNO/c12-10-5-3-4-9(8-10)11(14)6-1-2-7-13/h3-5,8H,1-2,6H2
• InChIKey: YTHMEBHXUQHFJG-UHFFFAOYSA-N

Properties

• Density: 1.181g/cm³ (Cal.)
• Boiling point: 387.406°C at 760 mmHg (Cal.)
• Flash point: 188.097°C (Cal.)
• Refractive index: 1.537 (Cal.)