Isosorbide Dicaprylate Chemical Formula

[(3S,3aR,6R,6aR)-6-octanoyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] octanoate
Isosorbide Dicaprylate CAS No: 64896-70-4 Isosorbide Dicaprylate Molecular formula: C22H38O6 PubChem CID: 10501064

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Isosorbide Dicaprylate Structure

Isosorbide Dicaprylate structure
1.50×

Isosorbide Dicaprylate Formula

CAS Number
64896-70-4
Molecular formula
C22H38O6
Molecular weight
398.5
Exact mass
398.26683893
IUPAC name
[(3S,3aR,6R,6aR)-6-octanoyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] octanoate
SMILES
CCCCCCCC(=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2OC(=O)CCCCCCC
InChI
InChI=1S/C22H38O6/c1-3-5-7-9-11-13-19(23)27-17-15-25-22-18(16-26-21(17)22)28-20(24)14-12-10-8-6-4-2/h17-18,21-22H,3-16H2,1-2H3/t17-,18+,21-,22-/m1/s1
InChIKey
BIOGOMUNGWOQHV-GMQQQROESA-N
Data source: Pubchem view

Isosorbide Dicaprylate Synonyms (22 total)

0IK29C4889 64896-70-4 BIOGOMUNGWOQHV-GMQQQROESA-N DTXCID10137710 DTXSID60215219 EC 807-840-4 Furo(3,2-b)furan, D-glucitol deriv Isosorbide dicaprylate ISOSORBIDE DICAPRYLATE [INCI] Nikkol sorester 208 RefChem:792333 SCHEMBL50126 Synovea DOI UNII-0IK29C4889 1,4:3,6-dianhydro-2,5-di-O-octanoyl-D-glucitol (3R,3aR,6S,6aR)-hexahydrofuro[3,2-b]furan-3,6-diyl dioctanoate (3R,3aR,6S,6aR)-Hexahydrofuro(3,2-b)furan-3,6-diyl dioctanoate (3R,3aR,6S,6aR)-Hexahydrofuro[3,2-b]furan-3,6-diyl Dioctanoate; [(3S,3aR,6R,6aR)-6-octanoyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] octanoate 807-840-4

Isosorbide Dicaprylate Safety & hazards

No hazard data on file.

Data sourced from PubChem