5-[(1R,3aR,4S,6aR)-4-(1,3-Benzodioxol-5-Yl)-1,3,3a,4,6,6a-Hexahydrofuro[4,3-c]Furan-1-Yl]-1,3-Benzodioxole
[CAS# 133-03-9]

Identification

• Name: 5-[(1R,3aR,4S,6aR)-4-(1,3-Benzodioxol-5-Yl)-1,3,3a,4,6,6a-Hexahydrofuro[4,3-c]Furan-1-Yl]-1,3-Benzodioxole
• Synonyms: Acon1_000986; Kbio2_004604; Kbio2_007172
• Molecular Formula: C₂₀H₁₈O₆
• Molecular Weight: 354.36
• CAS Registry Number: 133-03-9
• SMILES: [C@@H]14[C@@H]([C@H](OC1)C3=CC=C2OCOC2=C3)CO[C@H]4C6=CC5=C(OCO5)C=C6
• InChI: 1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19-,20+/m0/s1
• InChIKey: PEYUIKBAABKQKQ-WZBLMQSHSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 504.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 212.3±30.0°C (Cal.)