1-Isocyano-3-nitrobenzene

CAS Registry Number®

2008-59-5
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CAS Name

1-Isocyano-3-nitrobenzene

Molecular Formula

C7H4N2O2

Cite this Page

1-Isocyano-3-nitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2008-59-5 (retrieved 2024-09-01) (CAS RN: 2008-59-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    97-99 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H4N2O2/c1-8-6-3-2-4-7(5-6)9(10)11/h2-5H

InChIKey

InChIKey=YZCSJSFXYQDTCK-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC([N+]#[C-])=CC=C1

Canonical SMILES

[C-]#[N+]C1=CC=CC(=C1)N(=O)=O

Other Names for this Substance

  • Benzene, 1-isocyano-3-nitro-
  • Phenyl isocyanide, m-nitro-
  • 1-Isocyano-3-nitrobenzene
  • m-Nitrophenyl isocyanide