(1R,2R,5S,6S)-1-Ethyltricyclo[4.2.1.1^2,5]dec-3-en-9-one
[CAS# 640756-28-1]

Identification

• Name: (1R,2R,5S,6S)-1-Ethyltricyclo[4.2.1.1^2,5]dec-3-en-9-one
• Synonyms: (1R,2R,5S,6S)-1-ethyltricyclo[4.2.1.12,5]dec-3-en-9-one
• Molecular Formula: C₁₂H₁₆O
• Molecular Weight: 176.25
• CAS Registry Number: 640756-28-1
• SMILES: CC[C@]12CC[C@H](C1=O)[C@H]3C[C@@H]2C=C3
• InChI: 1S/C12H16O/c1-2-12-6-5-10(11(12)13)8-3-4-9(12)7-8/h3-4,8-10H,2,5-7H2,1H3/t8-,9+,10+,12-/m1/s1
• InChIKey: IOAUHSFAFNHVEE-FYLLDIAZSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 264.3±9.0°C at 760 mmHg (Cal.)
• Flash point: 107.0±13.7°C (Cal.)
• Refractive index: 1.546 (Cal.)