(1S,3S,4R,8R)-3-Allyl-8-methoxy-1,8-dimethylbicyclo[2.2.2]oct-5-en-2-one
[CAS# 791854-94-9]

Identification

• Name: (1S,3S,4R,8R)-3-Allyl-8-methoxy-1,8-dimethylbicyclo[2.2.2]oct-5-en-2-one
• Synonyms: (1S,3S,4R,8R)-3-allyl-8-methoxy-1,8-dimethylbicyclo[2.2.2]oct-5-en-2-one
• Molecular Formula: C₁₄H₂₀O₂
• Molecular Weight: 220.31
• CAS Registry Number: 791854-94-9
• SMILES: C[C@]12C[C@@]([C@H](C=C1)[C@@H](C2=O)CC=C)(C)OC
• InChI: 1S/C14H20O2/c1-5-6-10-11-7-8-13(2,12(10)15)9-14(11,3)16-4/h5,7-8,10-11H,1,6,9H2,2-4H3/t10-,11+,13+,14+/m0/s1
• InChIKey: CILJZCQHBLSLRG-OIMNJJJWSA-N

Properties

• Density: 1.02g/cm³ (Cal.)
• Boiling point: 280.657°C at 760 mmHg (Cal.)
• Flash point: 103.501°C (Cal.)
• Refractive index: 1.507 (Cal.)