6-(1-Heptyn-1-Yl)-2-Hydroxy-2,4,6-Cycloheptatrien-1-One
[CAS# 376390-59-9]

Identification

• Name: 6-(1-Heptyn-1-Yl)-2-Hydroxy-2,4,6-Cycloheptatrien-1-One
• Synonyms: 4-(hept-1-yn-1-yl)-2-hydroxycyclohepta-2,4,6-trienone
• Molecular Formula: C₁₄H₁₆O₂
• Molecular Weight: 216.28
• CAS Registry Number: 376390-59-9
• SMILES: O=C1/C=C(/C#CCCCCC)\C=C/C=C1/O
• InChI: 1S/C14H16O2/c1-2-3-4-5-6-8-12-9-7-10-13(15)14(16)11-12/h7,9-11H,2-5H2,1H3,(H,15,16)
• InChIKey: JUFSUJIWDJNUKY-UHFFFAOYSA-N

Properties

• Density: 1.09g/cm³ (Cal.)
• Boiling point: 331.724°C at 760 mmHg (Cal.)
• Flash point: 140.987°C (Cal.)
• Refractive index: 1.556 (Cal.)