1-[(3aS,6aS)-2,3,4,6a-Tetrahydro-3a(1H)-pentalenyl]ethanone
[CAS# 69984-47-0]

Identification

• Name: 1-[(3aS,6aS)-2,3,4,6a-Tetrahydro-3a(1H)-pentalenyl]ethanone
• Synonyms: 1-((3aS,6aS)-1,2,3,3a,4,6a-hexahydropentalen-3a-yl)ethanone
• Molecular Formula: C₁₀H₁₄O
• Molecular Weight: 150.22
• CAS Registry Number: 69984-47-0
• SMILES: CC(=O)[C@]12CCC[C@H]1C=CC2
• InChI: 1S/C10H14O/c1-8(11)10-6-2-4-9(10)5-3-7-10/h2,4,9H,3,5-7H2,1H3/t9-,10+/m1/s1
• InChIKey: DWTNTOCLVKQVEX-ZJUUUORDSA-N

Properties

• Density: 1.056g/cm³ (Cal.)
• Boiling point: 216.485°C at 760 mmHg (Cal.)
• Flash point: 80.582°C (Cal.)