2,2′,4,4′,6,6′-Hexanitrodiphenyl sulfone

CAS Registry Number®

10580-80-0

CAS Name

2,2′,4,4′,6,6′-Hexanitrodiphenyl sulfone

Molecular Formula

C12H4N6O14S

Molecular Mass

488.26

Cite this Page

2,2′,4,4′,6,6′-Hexanitrodiphenyl sulfone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10580-80-0 (retrieved 2024-11-28) (CAS RN: 10580-80-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    335-345 °C (decomp)
  • Density (1)

    1.1 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H4N6O14S/c19-13(20)5-1-7(15(23)24)11(8(2-5)16(25)26)33(31,32)12-9(17(27)28)3-6(14(21)22)4-10(12)18(29)30/h1-4H

InChIKey

InChIKey=LBSKWFDEDNVDAU-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C1=C(N(=O)=O)C=C(N(=O)=O)C=C1N(=O)=O)C2=C(N(=O)=O)C=C(N(=O)=O)C=C2N(=O)=O

Canonical SMILES

O=N(=O)C=1C=C(C(=C(C1)N(=O)=O)S(=O)(=O)C=2C(=CC(=CC2N(=O)=O)N(=O)=O)N(=O)=O)N(=O)=O

Other Names for this Substance

  • Benzene, 1,1′-sulfonylbis[2,4,6-trinitro-
  • Sulfone, bis(2,4,6-trinitrophenyl)
  • Picryl sulfone
  • 1,1′-Sulfonylbis[2,4,6-trinitrobenzene]
  • Dipicryl sulfone

CAS INSIGHTSTM
Hourglass and a clock