4-(4-Nitrophenyl)-1H-1,2,3-triazole-5-carbonitrile

CAS Registry Number®

39807-68-6
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CAS Name

4-(4-Nitrophenyl)-1H-1,2,3-triazole-5-carbonitrile

Molecular Formula

C9H5N5O2

Molecular Mass

215.17

Cite this Page

4-(4-Nitrophenyl)-1H-1,2,3-triazole-5-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39807-68-6 (retrieved 2024-08-31) (CAS RN: 39807-68-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H5N5O2/c10-5-8-9(12-13-11-8)6-1-3-7(4-2-6)14(15)16/h1-4H,(H,11,12,13)

InChIKey

InChIKey=LRPPUSZMPRBCAU-UHFFFAOYSA-N

SMILES

C(#N)C1=C(NN=N1)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

N#CC=1N=NNC1C=2C=CC(=CC2)N(=O)=O

Other Names for this Substance

  • 1H-1,2,3-Triazole-5-carbonitrile, 4-(4-nitrophenyl)-
  • 1H-1,2,3-Triazole-4-carbonitrile, 5-(4-nitrophenyl)-
  • 4-(4-Nitrophenyl)-1H-1,2,3-triazole-5-carbonitrile