10,15-Dihydro-5H-Tribenzo[A,D,G]Cyclononene-2,3,7,8,12,13-Hexol
[CAS# 1506-76-9]

Identification

• Classification: Chemical reagent >> Organic reagent >> Aromatic alcohol
• Name: 10,15-Dihydro-5H-Tribenzo[A,D,G]Cyclononene-2,3,7,8,12,13-Hexol
• Molecular Formula: C₂₁H₁₈O₆
• Molecular Weight: 366.37
• CAS Registry Number: 1506-76-9
• SMILES: C1=C(O)C(=CC3=C1CC2=CC(=C(C=C2CC4=C(C3)C=C(O)C(=C4)O)O)O)O
• InChI: 1S/C21H18O6/c22-16-4-10-1-11-5-17(23)19(25)7-13(11)3-15-9-21(27)20(26)8-14(15)2-12(10)6-18(16)24/h4-9,22-27H,1-3H2
• InChIKey: OOBDZXQTZWOBBQ-UHFFFAOYSA-N

Properties

• Density: 1.529g/cm³ (Cal.)
• Boiling point: 717.101°C at 760 mmHg (Cal.)
• Flash point: 337.191°C (Cal.)

References

• (1): C. J. Sumby and M. J. Hardie. 2,3,7,8,12,13-Hexahydroxy-10,15-dihydro-5H-tribenzo[a,d,g]cyclononene acetone disolvate, Acta Cryst. (2007). E63, o1537-o1539