Pentacyclo[4.3.0.02,5.03,8.04,7]Nonane
[CAS# 452-61-9]

Identification

• Name: Pentacyclo[4.3.0.02,5.03,8.04,7]Nonane
• Synonyms: Pentacyclo[4.3.0.02,5.03,8.04,7]Nonane
• Molecular Formula: C₉H₁₀
• Molecular Weight: 118.18
• CAS Registry Number: 452-61-9
• SMILES: C2C4C1C5C3C1C2C3C45
• InChI: 1S/C9H10/c1-2-4-6-3(1)7-5(2)8(4)9(6)7/h2-9H,1H2
• InChIKey: PAJGEKALYKVXNG-UHFFFAOYSA-N

Properties

• Density: 1.411g/cm³ (Cal.)
• Boiling point: 161.667°C at 760 mmHg (Cal.)
• Flash point: 25.113°C (Cal.)

References

• (1): Phillip Lightfoot, Patrizia Pareschi and John C. Walton. Comparison of hydrogen abstraction and homolytic substitution in pentacyclo[4.n.0.0.0.0]alkanes, J. Chem. Soc., Perkin Trans. 2, 2002, 0, 918.