2,2-Dinitro-1,3-propanediol

CAS Registry Number®

2736-80-3
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CAS Name

2,2-Dinitro-1,3-propanediol

Molecular Formula

C3H6N2O6

Molecular Mass

166.09

Cite this Page

2,2-Dinitro-1,3-propanediol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2736-80-3 (retrieved 2024-09-11) (CAS RN: 2736-80-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    140 °C @ Press: 2-3 Torr

  • Melting Point (2)

    145-148 °C

  • Density (2)

    1.54 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C3H6N2O6/c6-1-3(2-7,4(8)9)5(10)11/h6-7H,1-2H2

InChIKey

InChIKey=IUKKSAGYDLAHGF-UHFFFAOYSA-N

SMILES

C(N(=O)=O)(N(=O)=O)(CO)CO

Canonical SMILES

O=N(=O)C(N(=O)=O)(CO)CO

Other Names for this Substance

  • 1,3-Propanediol, 2,2-dinitro-
  • 2,2-Dinitro-1,3-propanediol
  • NSC 2694