2,2,2-Trinitroacetonitrile

CAS Registry Number®

630-72-8

CAS Name

2,2,2-Trinitroacetonitrile

Molecular Formula

C2N4O6

Molecular Mass

176.04

Cite this Page

2,2,2-Trinitroacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=630-72-8 (retrieved 2024-11-13) (CAS RN: 630-72-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    45 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C2N4O6/c3-1-2(4(7)8,5(9)10)6(11)12

InChIKey

InChIKey=CPHSXUIZSJHWLU-UHFFFAOYSA-N

SMILES

C(N(=O)=O)(N(=O)=O)(N(=O)=O)C#N

Canonical SMILES

N#CC(N(=O)=O)(N(=O)=O)N(=O)=O

Other Names for this Substance

  • Acetonitrile, 2,2,2-trinitro-
  • Acetonitrile, trinitro-
  • 2,2,2-Trinitroacetonitrile
  • Trinitroacetonitrile
  • Cyanotrinitromethane

CAS INSIGHTSTM
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