Cubebin
[CAS# 18423-69-3]

Identification

• Name: Cubebin
• Synonyms: (2S,3R,4R)-3,4-Bis(1,3-Benzodioxol-5-Ylmethyl)Tetrahydrofuran-2-Ol; (2S,3R,4R)-3,4-Bis(1,3-Benzodioxol-5-Ylmethyl)-2-Tetrahydrofuranol
• Molecular Formula: C₂₀H₂₀O₆
• Molecular Weight: 356.37
• CAS Registry Number: 18423-69-3
• EINECS: 242-300-6
• SMILES: [C@H]1([C@H](CO[C@@H]1O)CC3=CC=C2OCOC2=C3)CC5=CC=C4OCOC4=C5
• InChI: 1S/C20H20O6/c21-20-15(6-13-2-4-17-19(8-13)26-11-24-17)14(9-22-20)5-12-1-3-16-18(7-12)25-10-23-16/h1-4,7-8,14-15,20-21H,5-6,9-11H2/t14-,15+,20-/m0/s1
• InChIKey: DIYWRNLYKJKHAM-MDOVXXIYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 526.8±50.0°C at 760 mmHg (Cal.)
• Flash point: 272.4±30.1°C (Cal.)