3,5-Heptadiyn-2-One
[CAS# 13879-71-5]

Identification

• Name: 3,5-Heptadiyn-2-One
• Molecular Formula: C₇H₆O
• Molecular Weight: 106.12
• CAS Registry Number: 13879-71-5
• SMILES: O=C(C#CC#CC)C
• InChI: 1S/C7H6O/c1-3-4-5-6-7(2)8/h1-2H3
• InChIKey: WAXKZOQSCPDRLB-UHFFFAOYSA-N

Properties

• Density: 0.984g/cm³ (Cal.)
• Boiling point: 161.624°C at 760 mmHg (Cal.)
• Flash point: 49.663°C (Cal.)
• Refractive index: 1.478 (Cal.)