Isosorbide dinitrate

CAS Registry Number®

87-33-2

CAS Name

Isosorbide dinitrate

Molecular Formula

C6H8N2O8

Molecular Mass

236.14

Cite this Page

Isosorbide dinitrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54650-95-2 (retrieved 2024-12-22) (CAS RN: 87-33-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    70 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4+,5-,6-/m1/s1

InChIKey

InChIKey=MOYKHGMNXAOIAT-JGWLITMVSA-N

SMILES

O(N(=O)=O)[C@H]1[C@@]2([C@@]([C@@H](ON(=O)=O)CO2)(OC1)[H])[H]

Canonical SMILES

O=N(=O)OC1COC2C(ON(=O)=O)COC12

Other Names for this Substance

  • D-Glucitol, 1,4:3,6-dianhydro-, 2,5-dinitrate
  • Glucitol, 1,4:3,6-dianhydro-, dinitrate, D-
  • D-Glucitol, 1,4:3,6-dianhydro-, dinitrate
  • Glucitol, 1,4:3,6-dianhydro-, dinitrate
  • Sorbitol, 1,4:3,6-dianhydro-, dinitrate

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Deleted or Replaced CAS Registry Numbers

6659-58-1, 54650-95-2

CAS INSIGHTSTM
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