3,5-Dihydroxy-6,6-Dimethyl-2-(2-Methylbutanoyl)-4-[[2,4,6-Trihydroxy-3-Methyl-5-(2-Methylbutanoyl)Phenyl]Methyl]Cyclohexa-2,4-Dien-1-One
[CAS# 112663-70-4]

Identification

• Name: 3,5-Dihydroxy-6,6-Dimethyl-2-(2-Methylbutanoyl)-4-[[2,4,6-Trihydroxy-3-Methyl-5-(2-Methylbutanoyl)Phenyl]Methyl]Cyclohexa-2,4-Dien-1-One
• Synonyms: 3,5-Dihydroxy-6,6-Dimethyl-2-(2-Methyl-1-Oxobutyl)-4-[[2,4,6-Trihydroxy-3-Methyl-5-(2-Methyl-1-Oxobutyl)Phenyl]Methyl]-1-Cyclohexa-2,4-Dienone; 3,5-Dihydroxy-6,6-Dimethyl-2-(2-Methylbutanoyl)-4-[2,4,6-Trihydroxy-3-Methyl-5-(2-Methylbutanoyl)Benzyl]Cyclohexa-2,4-Dien-1-One; 2,5-Cyclohexadien-1-One, 3,5-Dihydroxy-4,4-Dimethyl-2-(2-Methyl-1-Oxobutyl)-6-((2,4,6-Trihydroxy-3-Methyl-5-(2-Methyl-1-Oxopropyl)Phenyl)Methyl)-
• Molecular Formula: C₂₆H₃₄O₈
• Molecular Weight: 474.55
• CAS Registry Number: 112663-70-4
• SMILES: C(C1=C(O)C(C(=O)C(=C1O)C(=O)C(CC)C)(C)C)C2=C(O)C(=C(O)C(=C2O)C)C(=O)C(CC)C
• InChI: 1S/C26H34O8/c1-8-11(3)18(27)16-21(30)13(5)20(29)14(22(16)31)10-15-23(32)17(19(28)12(4)9-2)25(34)26(6,7)24(15)33/h11-12,29-33H,8-10H2,1-7H3
• InChIKey: GOYXOMCJMHZWTD-UHFFFAOYSA-N

Properties

• Density: 1.295g/cm³ (Cal.)
• Boiling point: 721.627°C at 760 mmHg (Cal.)
• Flash point: 404.172°C (Cal.)