Isochromeno[4,3-c]Chromene-6,11-Dione
[CAS# 2288-98-4]

Identification

• Name: Isochromeno[4,3-c]Chromene-6,11-Dione
• Synonyms: Isochromeno[4,3-C]Chromene-6,11-Quinone; A2569/0109507; Zinc00129814
• Molecular Formula: C₁₆H₈O₄
• Molecular Weight: 264.24
• CAS Registry Number: 2288-98-4
• SMILES: C1=CC=CC2=C1C4=C(OC2=O)C3=CC=CC=C3OC4=O
• InChI: 1S/C16H8O4/c17-15-10-6-2-1-5-9(10)13-14(20-15)11-7-3-4-8-12(11)19-16(13)18/h1-8H
• InChIKey: CQOQPUAAVDHXQM-UHFFFAOYSA-N

Properties

• Density: 1.493g/cm³ (Cal.)
• Boiling point: 488.636°C at 760 mmHg (Cal.)
• Flash point: 260.463°C (Cal.)

References

• (1): Heiko Leutbecher, Gerhard Greiner, Robert Amann, Andreas Stolz, Uwe Beifuss and Jürgen Conrad. Laccase-catalyzed phenol oxidation. Rapid assignment of ring-proton deficient polycyclic benzofuran regioisomers by experimental H–C long-range coupling constants and DFT-predicted product formation, Org. Biomol. Chem., 2011, 9, 2667.