2-Methyl-2-(5-oxo-3-hexyn-1-yl)cyclohexanone
[CAS# 790227-68-8]

Identification

• Name: 2-Methyl-2-(5-oxo-3-hexyn-1-yl)cyclohexanone
• Synonyms: 2-methyl-2-(5-oxohex-3-yn-1-yl)cyclohexanone
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 790227-68-8
• SMILES: CC(=O)C#CCCC1(CCCCC1=O)C
• InChI: 1S/C13H18O2/c1-11(14)7-3-5-9-13(2)10-6-4-8-12(13)15/h4-6,8-10H2,1-2H3
• InChIKey: VNAUXTYSZNTHFJ-UHFFFAOYSA-N

Properties

• Density: 1.004g/cm³ (Cal.)
• Boiling point: 322.544°C at 760 mmHg (Cal.)
• Flash point: 134.428°C (Cal.)
• Refractive index: 1.48 (Cal.)