1-[(1S,2S,4S)-Bicyclo[2.2.1]hept-5-en-2-yl]-1-hexanone
[CAS# 628716-55-2]

Identification

• Name: 1-[(1S,2S,4S)-Bicyclo[2.2.1]hept-5-en-2-yl]-1-hexanone
• Synonyms: 1-((1S,2S,4S)-bicyclo[2.2.1]hept-5-en-2-yl)hexan-1-one
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 628716-55-2
• SMILES: O=C([C@H]1C[C@H]2/C=C\[C@@H]1C2)CCCCC
• InChI: 1S/C13H20O/c1-2-3-4-5-13(14)12-9-10-6-7-11(12)8-10/h6-7,10-12H,2-5,8-9H2,1H3/t10-,11+,12-/m0/s1
• InChIKey: DZVILVOROIHFNK-TUAOUCFPSA-N

Properties

• Density: 0.982g/cm³ (Cal.)
• Boiling point: 277.589°C at 760 mmHg (Cal.)
• Flash point: 112.304°C (Cal.)
• Refractive index: 1.5 (Cal.)