3,3',4',5,7-Pentahydroxy-6-Methylflavone
[CAS# 491-49-6]

Identification

• Name: 3,3',4',5,7-Pentahydroxy-6-Methylflavone
• Synonyms: 2-(3,4-Dihydroxyphenyl)-3,5,7-Trihydroxy-6-Methyl-Chromen-4-One; 2-(3,4-Dihydroxyphenyl)-3,5,7-Trihydroxy-6-Methyl-4-Chromenone; 2-(3,4-Dihydroxyphenyl)-3,5,7-Trihydroxy-6-Methyl-Chromone
• Molecular Formula: C₁₆H₁₂O₇
• Molecular Weight: 316.27
• CAS Registry Number: 491-49-6
• SMILES: C1=C(O)C(=C(O)C2=C1OC(=C(O)C2=O)C3=CC(=C(O)C=C3)O)C
• InChI: 1S/C16H12O7/c1-6-9(18)5-11-12(13(6)20)14(21)15(22)16(23-11)7-2-3-8(17)10(19)4-7/h2-5,17-20,22H,1H3
• InChIKey: DTFXGVGIKNSCQQ-UHFFFAOYSA-N

Properties

• Density: 1.716g/cm³ (Cal.)
• Boiling point: 650.183°C at 760 mmHg (Cal.)
• Flash point: 247.502°C (Cal.)