Isosorbide dioctanoate

CAS Registry Number®

64896-70-4

CAS Name

Isosorbide dioctanoate

Molecular Formula

C22H38O6

Molecular Mass

398.53

Cite this Page

Isosorbide dioctanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64896-70-4 (retrieved 2024-12-23) (CAS RN: 64896-70-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Density (1)

    1.06 g/cm³

Source(s)

Other Names and Identifiers

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

InChIKey=BIOGOMUNGWOQHV-GMQQQROESA-N

SMILES

O(C(CCCCCCC)=O)[C@@H]1[C@@]2([C@@]([C@H](OC(CCCCCCC)=O)CO2)(OC1)[H])[H]

Canonical SMILES

O=C(OC1COC2C(OC(=O)CCCCCCC)COC12)CCCCCCC

Other Names for this Substance

  • D-Glucitol, 1,4:3,6-dianhydro-, 2,5-dioctanoate
  • D-Glucitol, 1,4:3,6-dianhydro-, dioctanoate
  • Furo[3,2-b]furan, D-glucitol deriv.
  • Isosorbide dioctanoate
  • Isosorbide dicaprylate

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Deleted or Replaced CAS Registry Numbers

181895-31-8, 185325-53-5

CAS INSIGHTSTM
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