(1R,2R,5R,6R)-3-Ethynyltricyclo[4.2.0.0^2,5]Octa-3,7-Diene
[CAS# 163333-05-9]

Identification

• Name: (1R,2R,5R,6R)-3-Ethynyltricyclo[4.2.0.0^2,5]Octa-3,7-Diene
• Synonyms: (1R,2R,5R,6S)-3-ethynyltricyclo[4.2.0.02,5]octa-3,7-diene
• Molecular Formula: C₁₀H₈
• Molecular Weight: 128.17
• CAS Registry Number: 163333-05-9
• SMILES: C#CC1=C[C@@H]2[C@H]1[C@H]3[C@@H]2C=C3
• InChI: 1S/C10H8/c1-2-6-5-9-7-3-4-8(7)10(6)9/h1,3-5,7-10H/t7-,8+,9-,10+/m0/s1
• InChIKey: MFOCKABXDDAONC-QCLAVDOMSA-N

Properties

• Density: 1.151g/cm³ (Cal.)
• Boiling point: 192.744°C at 760 mmHg (Cal.)
• Flash point: 57.108°C (Cal.)
• Refractive index: 1.628 (Cal.)