(3aS,4R,8R,11E,12aR)-11-[(Acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione
[CAS# 56650-63-6]

Identification

• Name: (3aS,4R,8R,11E,12aR)-11-[(Acetyloxy)methyl]-8-ethoxy-3a,4,8,9,10,12a-hexahydro-3-methylene-6H-4,7-Methenofuro[3,2-c]oxacycloundecin-2,6(3H)-dione
• Synonyms: Nsc306948
• Molecular Formula: C₁₉H₂₂O₇
• Molecular Weight: 362.38
• CAS Registry Number: 56650-63-6
• SMILES: C(OC2C3=CC(C1C(C(=O)OC1\C=C(CC2)\COC(C)=O)=C)OC3=O)C
• InChI: 1S/C19H22O7/c1-4-23-14-6-5-12(9-24-11(3)20)7-15-17(10(2)18(21)25-15)16-8-13(14)19(22)26-16/h7-8,14-17H,2,4-6,9H2,1,3H3/b12-7+
• InChIKey: IAHRRUNNPWEGOH-KPKJPENVSA-N

Properties

• Density: 1.276g/cm³ (Cal.)
• Boiling point: 602.809°C at 760 mmHg (Cal.)
• Flash point: 265.253°C (Cal.)