6-[(E)-2-(1,3-Benzodioxol-5-Yl)Vinyl]-4,5-Dimethoxy-2H-Pyran-2-One
[CAS# 52525-96-9]

Identification

• Name: 6-[(E)-2-(1,3-Benzodioxol-5-Yl)Vinyl]-4,5-Dimethoxy-2H-Pyran-2-One
• Synonyms: 5-Methoxy-5,6-dehydromethysticin; 6-[(E)-2-(1,3-Benzodioxol-5-yl)ethenyl]-4,5-dimethoxy-2H-pyran-2-one #
• Molecular Formula: C₁₆H₁₄O₆
• Molecular Weight: 302.28
• CAS Registry Number: 52525-96-9
• SMILES: O=C/1O/C(=C(/OC)\C(\OC)=C\1)/C=C/c2ccc3OCOc3c2
• InChI: 1S/C16H14O6/c1-18-14-8-15(17)22-12(16(14)19-2)6-4-10-3-5-11-13(7-10)21-9-20-11/h3-8H,9H2,1-2H3/b6-4+
• InChIKey: OCTOUTVGBYMWGI-GQCTYLIASA-N

Properties

• Density: 1.355g/cm³ (Cal.)
• Boiling point: 562.527°C at 760 mmHg (Cal.)
• Flash point: 252.362°C (Cal.)