(2S,3R,3aR,3bS,4Z,6aR,7aS)-4-[(2E)-2-(3,3-Dimethylcyclohexylidene)ethylidene]-5-oxooctahydrodifuro[2,3-b:3',2'-d]furan-2,3-diyl diacetate
[CAS# 96313-95-0]

Identification

• Name: (2S,3R,3aR,3bS,4Z,6aR,7aS)-4-[(2E)-2-(3,3-Dimethylcyclohexylidene)ethylidene]-5-oxooctahydrodifuro[2,3-b:3',2'-d]furan-2,3-diyl diacetate
• Molecular Formula: C₂₂H₂₈O₈
• Molecular Weight: 420.45
• CAS Registry Number: 96313-95-0
• SMILES: CC1(C)CCC/C(C1)=C\C=C2/C(=O)O[C@H]3O[C@H]4O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4[C@@H]23
• InChI: 1S/C22H28O8/c1-11(23)26-17-16-15-14(8-7-13-6-5-9-22(3,4)10-13)18(25)28-19(15)29-20(16)30-21(17)27-12(2)24/h7-8,15-17,19-21H,5-6,9-10H2,1-4H3/b13-7+,14-8-/t15-,16-,17-,19+,20+,21-/m1/s1
• InChIKey: LJWUZALDGBNRAU-KUBYQAIRSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 566.031°C at 760 mmHg (Cal.)
• Flash point: 245.419°C (Cal.)