4-Chloro-3,5-dinitrobenzonitrile

CAS Registry Number®

1930-72-9

CAS Name

4-Chloro-3,5-dinitrobenzonitrile

Molecular Formula

C7H2ClN3O4

Molecular Mass

227.56

Cite this Page

4-Chloro-3,5-dinitrobenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1930-72-9 (retrieved 2024-10-05) (CAS RN: 1930-72-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    143-144.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H2ClN3O4/c8-7-5(10(12)13)1-4(3-9)2-6(7)11(14)15/h1-2H

InChIKey

InChIKey=SCGDEDHSPCXGEC-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(Cl)C(N(=O)=O)=CC(C#N)=C1

Canonical SMILES

N#CC=1C=C(C(Cl)=C(C1)N(=O)=O)N(=O)=O

Other Names for this Substance

  • Benzonitrile, 4-chloro-3,5-dinitro-
  • 4-Chloro-3,5-dinitrobenzonitrile
  • 3,5-Dinitro-4-chlorobenzonitrile
  • NSC 74453
  • 1-Chloro-4-cyano-2,6-dinitrobenzene

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