4,6-Heptadiyn-3-One
[CAS# 29743-27-9]

Identification

• Name: 4,6-Heptadiyn-3-One
• Molecular Formula: C₇H₆O
• Molecular Weight: 106.12
• CAS Registry Number: 29743-27-9
• SMILES: O=C(C#CC#C)CC
• InChI: 1S/C7H6O/c1-3-5-6-7(8)4-2/h1H,4H2,2H3
• InChIKey: TXQOFPBBUQTJSD-UHFFFAOYSA-N

Properties

• Density: 0.98g/cm³ (Cal.)
• Boiling point: 156.278°C at 760 mmHg (Cal.)
• Flash point: 46.379°C (Cal.)
• Refractive index: 1.472 (Cal.)