(3Z)-3-(2,3-Dihydroxy-4-Methyl-6-Oxo-1-Cyclohexa-2,4-Dienylidene)-6-Methylcyclohex-5-Ene-1,2,4-Trione
[CAS# 128-68-7]

Identification

• Name: (3Z)-3-(2,3-Dihydroxy-4-Methyl-6-Oxo-1-Cyclohexa-2,4-Dienylidene)-6-Methylcyclohex-5-Ene-1,2,4-Trione
• Synonyms: (3Z)-3-(2,3-Dihydroxy-4-Methyl-6-Oxo-1-Cyclohexa-2,4-Dienylidene)-6-Methyl-Cyclohex-5-Ene-1,2,4-Trione; (3Z)-3-(2,3-Dihydroxy-6-Keto-4-Methyl-1-Cyclohexa-2,4-Dienylidene)-6-Methyl-Cyclohex-5-Ene-1,2,4-Trione; Phoenicine
• Molecular Formula: C₁₄H₁₀O₆
• Molecular Weight: 274.23
• CAS Registry Number: 128-68-7
• SMILES: CC2=CC(=O)C(=C1\C(=O)C(=O)C(=CC1=O)C)/C(=C2O)O
• InChI: 1S/C14H10O6/c1-5-3-7(15)9(13(19)11(5)17)10-8(16)4-6(2)12(18)14(10)20/h3-4,17,19H,1-2H3/b10-9+
• InChIKey: LAGMLQNYJKFAHG-MDZDMXLPSA-N

Properties

• Density: 1.636g/cm³ (Cal.)
• Boiling point: 332.164°C at 760 mmHg (Cal.)
• Flash point: 168.894°C (Cal.)