(3A's,4'S,5'S,5A'r,8A's,8B's)-5'-(Benzyloxy)Hexahydrodispiro[Cyclohexane-1,2'-[1,3]Dioxolo[4,5-e][1,3]Benzodioxole-7',1''-Cyclohexan]-4'-Ol
[CAS# 124601-98-5]

Identification

• Name: (3A's,4'S,5'S,5A'r,8A's,8B's)-5'-(Benzyloxy)Hexahydrodispiro[Cyclohexane-1,2'-[1,3]Dioxolo[4,5-e][1,3]Benzodioxole-7',1''-Cyclohexan]-4'-Ol
• Synonyms: 4-O-BENZYL-1,2:5,6-DI-O-CYCLOHEXYLIDENE-L-MYO-INOSITOL
• Molecular Formula: C₂₅H₃₄O₆
• Molecular Weight: 430.53
• CAS Registry Number: 124601-98-5
• SMILES: O3C6(O[C@@H]4[C@H]1OC5(O[C@@H]1[C@@H](OCc2ccccc2)[C@H](O)[C@H]34)CCCCC5)CCCCC6
• InChI: 1S/C25H34O6/c26-18-19(27-16-17-10-4-1-5-11-17)21-23(31-25(29-21)14-8-3-9-15-25)22-20(18)28-24(30-22)12-6-2-7-13-24/h1,4-5,10-11,18-23,26H,2-3,6-9,12-16H2/t18-,19-,20-,21+,22-,23-/m0/s1
• InChIKey: IADVUVVIWYXFFK-FHEJEKGWSA-N

Properties

• Density: 1.272g/cm³ (Cal.)
• Boiling point: 598.452°C at 760 mmHg (Cal.)
• Flash point: 315.733°C (Cal.)
• Refractive index: 1.592 (Cal.)