1-(2-Chloro-4-pyridinyl)-2-ethyl-1-hexanone
[CAS# 898785-71-2]

Identification

• Name: 1-(2-Chloro-4-pyridinyl)-2-ethyl-1-hexanone
• Synonyms: 3-Chloro-4-pyridyl 1-ethylpentyl ketone
• Molecular Formula: C₁₃H₁₈ClNO
• Molecular Weight: 239.74
• CAS Registry Number: 898785-71-2
• SMILES: O=C(c1ccnc(Cl)c1)C(CC)CCCC
• InChI: 1S/C13H18ClNO/c1-3-5-6-10(4-2)13(16)11-7-8-15-12(14)9-11/h7-10H,3-6H2,1-2H3
• InChIKey: IETJMRHUVWBNTJ-UHFFFAOYSA-N

Properties

• Density: 1.063g/cm³ (Cal.)
• Boiling point: 349.122°C at 760 mmHg (Cal.)
• Flash point: 164.943°C (Cal.)
• Refractive index: 1.506 (Cal.)