9-Acetyl-9,9alpha-Dihydro-6alpha-Methyl-3-(3,5-Dimethyl-1,3-Heptadienyl)-6H-Furo[2,3-h]-2-Benzopyran-6,8(6aH)-Dione
[CAS# 53014-38-3]

Identification

• Name: 9-Acetyl-9,9alpha-Dihydro-6alpha-Methyl-3-(3,5-Dimethyl-1,3-Heptadienyl)-6H-Furo[2,3-h]-2-Benzopyran-6,8(6aH)-Dione
• Synonyms: (6Ar,9R,9Ar)-9-Acetyl-3-[(1E,3E,5S)-3,5-Dimethylhepta-1,3-Dienyl]-6A-Methyl-9,9A-Dihydrofuro[5,4-H]Isochromene-6,8-Quinone; (6Ar,9R,9Ar)-3-[(1E,3E,5S)-3,5-Dimethylhepta-1,3-Dienyl]-9-Ethanoyl-6A-Methyl-9,9A-Dihydrofuro[5,4-H]Isochromene-6,8-Dione; 6H-Furo(2,3-H)-2-Benzopyran-6,8(6Ah)-Dione, 9Acetyl-3-((1E,3E,5S)-3,5-Dimethyl-1,3-Heptadienyl)-9-9A-Dihydro-6A-Methyl
• Molecular Formula: C₂₃H₂₆O₅
• Molecular Weight: 382.46
• CAS Registry Number: 53014-38-3
• SMILES: [C@]23([C@@H](C1=COC(=CC1=CC2=O)/C=C/C(=C/[C@H](CC)C)C)[C@H](C(=O)C)C(O3)=O)C
• InChI: 1S/C23H26O5/c1-6-13(2)9-14(3)7-8-17-10-16-11-19(25)23(5)21(18(16)12-27-17)20(15(4)24)22(26)28-23/h7-13,20-21H,6H2,1-5H3/b8-7+,14-9+/t13-,20-,21-,23-/m0/s1
• InChIKey: GAIVGINVGXHEIA-ZAAJWPAISA-N

Properties

• Density: 1.192g/cm³ (Cal.)
• Boiling point: 607.425°C at 760 mmHg (Cal.)
• Flash point: 263.993°C (Cal.)