Haloquinone
[CAS# 80902-01-8]

Identification

• Name: Haloquinone
• Synonyms: 3-Acetyl-1,8-Dihydroxy-2-Methyl-Phenanthrene-9,10-Dione; 3-Acetyl-1,8-Dihydroxy-2-Methyl-Phenanthrene-9,10-Quinone; 3-Ethanoyl-1,8-Dihydroxy-2-Methyl-Phenanthrene-9,10-Dione
• Molecular Formula: C₁₇H₁₂O₅
• Molecular Weight: 296.28
• CAS Registry Number: 80902-01-8
• SMILES: C1=C2C(=C(O)C(=C1C(=O)C)C)C(=O)C(=O)C3=C2C=CC=C3O
• InChI: 1S/C17H12O5/c1-7-10(8(2)18)6-11-9-4-3-5-12(19)13(9)16(21)17(22)14(11)15(7)20/h3-6,19-20H,1-2H3
• InChIKey: CPYFLMXPZMBECD-UHFFFAOYSA-N

Properties

• Density: 1.454g/cm³ (Cal.)
• Boiling point: 614.207°C at 760 mmHg (Cal.)
• Flash point: 339.279°C (Cal.)