Benzenesulfonic acid, 2,4,6-trinitro-, sodium salt (1:1)

CAS Registry Number®

5400-70-4

CAS Name

Benzenesulfonic acid, 2,4,6-trinitro-, sodium salt (1:1)

Molecular Formula

C6H3N3O9S.Na

Cite this Page

Benzenesulfonic acid, 2,4,6-trinitro-, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5400-70-4 (retrieved 2024-11-22) (CAS RN: 5400-70-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    300 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C6H3N3O9S.Na/c10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15;/h1-2H,(H,16,17,18);

InChIKey

InChIKey=GKDJCGWMAOHYCJ-UHFFFAOYSA-N

SMILES

S(=O)(=O)(O)C1=C(N(=O)=O)C=C(N(=O)=O)C=C1N(=O)=O.[Na]

Canonical SMILES

[Na].O=N(=O)C=1C=C(C(=C(C1)N(=O)=O)S(=O)(=O)O)N(=O)=O

Other Names for this Substance

  • Benzenesulfonic acid, 2,4,6-trinitro-, sodium salt (1:1)
  • Benzenesulfonic acid, 2,4,6-trinitro-, sodium salt
  • 2,4,6-Trinitrobenzenesulfonic acid sodium salt
  • 2,4,6-Trinitrobenzene sodium sulfonate
  • Sodium 2,4,6-trinitrobenzenesulfonate

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