2-[[2,4-Dihydroxy-6-methoxy-5-methyl-3-(1-oxobutyl)phenyl]methyl]-3,5-dihydroxy-4,4-dimethyl-6-(1-oxobutyl)-2,5-cyclohexadien-1-one
[CAS# 989-54-8]

Identification

• Name: 2-[[2,4-Dihydroxy-6-methoxy-5-methyl-3-(1-oxobutyl)phenyl]methyl]-3,5-dihydroxy-4,4-dimethyl-6-(1-oxobutyl)-2,5-cyclohexadien-1-one
• Synonyms: 2-Butanoyl-4-[(3-Butanoyl-2,4-Dihydroxy-6-Methoxy-5-Methyl-Phenyl)Methyl]-3,5-Dihydroxy-6,6-Dimethyl-Cyclohexa-2,4-Dien-1-One; 4-[[2,4-Dihydroxy-6-Methoxy-5-Methyl-3-(1-Oxobutyl)Phenyl]Methyl]-3,5-Dihydroxy-6,6-Dimethyl-2-(1-Oxobutyl)-1-Cyclohexa-2,4-Dieno
• Molecular Formula: C₂₅H₃₂O₈
• Molecular Weight: 460.52
• CAS Registry Number: 989-54-8
• SMILES: C(C1=C(O)C(C(=O)C(=C1O)C(=O)CCC)(C)C)C2=C(OC)C(=C(O)C(=C2O)C(=O)CCC)C
• InChI: 1S/C25H32O8/c1-7-9-15(26)17-19(28)12(3)22(33-6)13(20(17)29)11-14-21(30)18(16(27)10-8-2)24(32)25(4,5)23(14)31/h28-31H,7-11H2,1-6H3
• InChIKey: RHHXCNHESMAVTJ-UHFFFAOYSA-N

Properties

• Density: 1.286g/cm³ (Cal.)
• Boiling point: 633.279°C at 760 mmHg (Cal.)
• Flash point: 209.467°C (Cal.)