(1R,2R,3R,4S,5S)-3-Ethynyltricyclo[3.2.1.0^2,4]Oct-6-Ene
[CAS# 221100-81-8]

Identification

• Name: (1R,2R,3R,4S,5S)-3-Ethynyltricyclo[3.2.1.0^2,4]Oct-6-Ene
• Synonyms: (1R,2R,3s,4S,5S)-3-ethynyltricyclo[3.2.1.02,4]oct-6-ene
• Molecular Formula: C₁₀H₁₀
• Molecular Weight: 130.19
• CAS Registry Number: 221100-81-8
• SMILES: C#C[C@H]2[C@H]3[C@H]/1C[C@H](\C=C\1)[C@@H]23
• InChI: 1S/C10H10/c1-2-8-9-6-3-4-7(5-6)10(8)9/h1,3-4,6-10H,5H2/t6-,7+,8+,9-,10+
• InChIKey: AXSMVARHQYZJPL-CBSGAUBZSA-N

Properties

• Density: 1.096g/cm³ (Cal.)
• Boiling point: 168.209°C at 760 mmHg (Cal.)
• Flash point: 42.62°C (Cal.)
• Refractive index: 1.585 (Cal.)