1,6-Dimethyl-8,9-Dihydronaphtho[8,7-g][1]Benzoxole-10,11-Dione
[CAS# 77769-21-2]

Identification

• Name: 1,6-Dimethyl-8,9-Dihydronaphtho[8,7-g][1]Benzoxole-10,11-Dione
• Synonyms: 1,6-Dimethyl-8,9-Dihydronaphtho[8,7-G]Benzofuran-10,11-Dione; 1,6-Dimethyl-8,9-Dihydronaphtho[8,7-G]Benzofuran-10,11-Quinone; Phenanthro(1,2-B)Furan-10,11-Dione, 8,9-Dihydro-1,6-Dimethyl-
• Molecular Formula: C₁₈H₁₄O₃
• Molecular Weight: 278.31
• CAS Registry Number: 77769-21-2
• SMILES: C4=C(C3=C(C1=C(C2=C(C=C1)C(=CCC2)C)C(C3=O)=O)O4)C
• InChI: 1S/C18H14O3/c1-9-4-3-5-12-11(9)6-7-13-15(12)17(20)16(19)14-10(2)8-21-18(13)14/h4,6-8H,3,5H2,1-2H3
• InChIKey: OYOSADAKNZWZGA-UHFFFAOYSA-N

Properties

• Density: 1.287g/cm³ (Cal.)
• Boiling point: 495.614°C at 760 mmHg (Cal.)
• Flash point: 244.565°C (Cal.)

References

• (1): J.-K. Qin, C.-Z. Liao, Y.-T. Wang, X.-Z. Bu, Z.-S. Huang and L.-Q. Gu. 8,9-Dihydro-1,6-dimethylphenanthro[1,2-b]furan-10,11-dione, Acta Cryst. (2005). E61, o804-o805