(1R,6beta)-7beta-[(E)-5-Hydroxy-4-Methyl-3-Pentenyl]-7-Methylbicyclo[4.1.0]Hept-2-Ene-3-Methanol
[CAS# 19888-27-8]

Identification

• Name: (1R,6beta)-7beta-[(E)-5-Hydroxy-4-Methyl-3-Pentenyl]-7-Methylbicyclo[4.1.0]Hept-2-Ene-3-Methanol
• Synonyms: (E)-5-[(1S,6R,7R)-4-(Hydroxymethyl)-7-Methyl-7-Bicyclo[4.1.0]Hept-4-Enyl]-2-Methyl-Pent-2-En-1-Ol; (E)-2-Methyl-5-[(1S,6R,7R)-7-Methyl-4-Methylol-7-Bicyclo[4.1.0]Hept-4-Enyl]Pent-2-En-1-Ol; Sirenin
• Molecular Formula: C₁₅H₂₄O₂
• Molecular Weight: 236.35
• CAS Registry Number: 19888-27-8
• SMILES: [C@@]1([C@@H]2[C@H]1C=C(CC2)CO)(CC\C=C(\CO)C)C
• InChI: 1S/C15H24O2/c1-11(9-16)4-3-7-15(2)13-6-5-12(10-17)8-14(13)15/h4,8,13-14,16-17H,3,5-7,9-10H2,1-2H3/b11-4+/t13-,14+,15+/m0/s1
• InChIKey: BOEUJLMNWCJKHN-KSMMAEIZSA-N

Properties

• Density: 1.037g/cm³ (Cal.)
• Boiling point: 367.47°C at 760 mmHg (Cal.)
• Flash point: 169.167°C (Cal.)