4-Nitrophthalonitrile

CAS Registry Number®

31643-49-9

CAS Name

4-Nitrophthalonitrile

Molecular Formula

C8H3N3O2

Molecular Mass

173.13

Cite this Page

4-Nitrophthalonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31643-49-9 (retrieved 2024-11-21) (CAS RN: 31643-49-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    142 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H3N3O2/c9-4-6-1-2-8(11(12)13)3-7(6)5-10/h1-3H

InChIKey

InChIKey=NTZMSBAAHBICLE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C=C1C#N)N(=O)=O

Other Names for this Substance

  • 1,2-Benzenedicarbonitrile, 4-nitro-
  • Phthalonitrile, 4-nitro-
  • 4-Nitro-1,2-benzenedicarbonitrile
  • 4-Nitrophthalonitrile
  • 3,4-Dicyanonitrobenzene

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration