2,2',4,4',5,5',8-Heptahydroxy-7,7'-Dimethyl[1,1'-Bianthracene]-9,9',10,10'-Tetrone
[CAS# 18693-31-7]

Identification

• Name: 2,2',4,4',5,5',8-Heptahydroxy-7,7'-Dimethyl[1,1'-Bianthracene]-9,9',10,10'-Tetrone
• Synonyms: 1,4,5,7-Tetrahydroxy-2-Methyl-8-(2,4,5-Trihydroxy-7-Methyl-9,10-Dioxo-1-Anthryl)Anthracene-9,10-Dione; 1,4,5,7-Tetrahydroxy-2-Methyl-8-(2,4,5-Trihydroxy-9,10-Diketo-7-Methyl-1-Anthryl)-9,10-Anthraquinone; 1,4,5,7-Tetrahydroxy-2-Methyl-8-(2,4,5-Trihydroxy-7-Methyl-9,10-Dioxo-Anthracen-1-Yl)Anthracene-9,10-Dione
• Molecular Formula: C₃₀H₁₈O₁₁
• Molecular Weight: 554.47
• CAS Registry Number: 18693-31-7
• SMILES: C3=C(C1=C(C(C2=C(C1=O)C(=CC(=C2O)C)O)=O)C(=C3O)C4=C(C=C(O)C6=C4C(C5=C(C(=CC(=C5)C)O)C6=O)=O)O)O
• InChI: 1S/C30H18O11/c1-8-3-10-17(11(31)4-8)28(39)20-15(35)6-13(33)18(23(20)27(10)38)19-14(34)7-16(36)21-24(19)30(41)25-22(29(21)40)12(32)5-9(2)26(25)37/h3-7,31-37H,1-2H3
• InChIKey: KCTDFZBYXBNTSP-UHFFFAOYSA-N

Properties

• Density: 1.757g/cm³ (Cal.)
• Boiling point: 1007.589°C at 760 mmHg (Cal.)
• Flash point: 576.925°C (Cal.)