3,4,4alpha,5,8,8alpha-Hexahydro-(1R,4R,4alphaS,5R,8S,8alphaR)-Rel-1,4:5,8-Dimethanonaphthalen-2(1H)-One
[CAS# 33163-94-9]

Identification

• Name: 3,4,4alpha,5,8,8alpha-Hexahydro-(1R,4R,4alphaS,5R,8S,8alphaR)-Rel-1,4:5,8-Dimethanonaphthalen-2(1H)-One
• Synonyms: 1,4:5,8-Dimethanonaphthalen-2(1H)-One, 3,4,4A,5,8,8A-Hexahydro-, (1Alpha,4Alpha,4Abeta,5Beta,8Beta,8Abeta)-
• Molecular Formula: C₁₂H₁₄O
• Molecular Weight: 174.24
• CAS Registry Number: 33163-94-9
• SMILES: O=C2C1C3C(C(C1)C2)C4CC3C=C4
• InChI: 1S/C12H14O/c13-10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12/h1-2,6-9,11-12H,3-5H2
• InChIKey: AWDQKLULSIAWOR-UHFFFAOYSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 284.259°C at 760 mmHg (Cal.)
• Flash point: 119.415°C (Cal.)