[(3aR,4R,6R,7Z,10Z,11aR)-6-Hydroxy-6,10-Dimethyl-3-Methylidene-2,9-Dioxo-3a,4,5,11alpha-Tetrahydrocyclodeca[b]Furan-4-Yl] 2-Methylpropanoate
[CAS# 59979-56-5]

Identification

• Name: [(3aR,4R,6R,7Z,10Z,11aR)-6-Hydroxy-6,10-Dimethyl-3-Methylidene-2,9-Dioxo-3a,4,5,11alpha-Tetrahydrocyclodeca[b]Furan-4-Yl] 2-Methylpropanoate
• Synonyms: [(3Ar,4R,6R,7Z,10Z,11Ar)-6-Hydroxy-6,10-Dimethyl-3-Methylene-2,9-Dioxo-3A,4,5,11A-Tetrahydrocyclodeca[B]Furan-4-Yl] 2-Methylpropanoate; 2-Methylpropanoic Acid [(3Ar,4R,6R,7Z,10Z,11Ar)-6-Hydroxy-6,10-Dimethyl-3-Methylene-2,9-Dioxo-3A,4,5,11A-Tetrahydrocyclodeca[B]Furan-4-Yl] Ester; 2-Methylpropionic Acid [(3Ar,4R,6R,7Z,10Z,11Ar)-6-Hydroxy-2,9-Diketo-6,10-Dimethyl-3-Methylene-3A,4,5,11A-Tetrahydrocyclodeca[D]Furan-4-Yl] Ester
• Molecular Formula: C₁₉H₂₄O₆
• Molecular Weight: 348.40
• CAS Registry Number: 59979-56-5
• SMILES: [C@@H]12[C@H](OC(=O)C1=C)\C=C(C(=O)\C=C/[C@](O)(C[C@H]2OC(=O)C(C)C)C)\C
• InChI: 1S/C19H24O6/c1-10(2)17(21)25-15-9-19(5,23)7-6-13(20)11(3)8-14-16(15)12(4)18(22)24-14/h6-8,10,14-16,23H,4,9H2,1-3,5H3/b7-6-,11-8-/t14-,15-,16+,19+/m1/s1
• InChIKey: DUQSSEQKLJQACA-XVBXXOAXSA-N

Properties

• Density: 1.207g/cm³ (Cal.)
• Boiling point: 530.536°C at 760 mmHg (Cal.)
• Flash point: 186.911°C (Cal.)