7-(6-Chloro-3-pyridinyl)-7-oxoheptanenitrile
[CAS# 890100-90-0]

Identification

• Name: 7-(6-Chloro-3-pyridinyl)-7-oxoheptanenitrile
• Synonyms: 7-(4-chloro-3-pyridyl)-7-oxoheptanenitrile
• Molecular Formula: C₁₂H₁₃ClN₂O
• Molecular Weight: 236.70
• CAS Registry Number: 890100-90-0
• SMILES: O=C(CCCCCC#N)c1cnc(Cl)cc1
• InChI: 1S/C12H13ClN2O/c13-12-7-6-10(9-15-12)11(16)5-3-1-2-4-8-14/h6-7,9H,1-5H2
• InChIKey: LKDMTHDZHRATTP-UHFFFAOYSA-N

Properties

• Density: 1.171g/cm³ (Cal.)
• Boiling point: 433.885°C at 760 mmHg (Cal.)
• Flash point: 216.206°C (Cal.)
• Refractive index: 1.529 (Cal.)