4-(2H-Tetrazol-5-yl)benzonitrile

CAS Registry Number®

14389-10-7

CAS Name

4-(2H-Tetrazol-5-yl)benzonitrile

Molecular Formula

C8H5N5

Molecular Mass

171.16

Cite this Page

4-(2H-Tetrazol-5-yl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14389-10-7 (retrieved 2024-11-24) (CAS RN: 14389-10-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    258-260 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H5N5/c9-5-6-1-3-7(4-2-6)8-10-12-13-11-8/h1-4H,(H,10,11,12,13)

InChIKey

InChIKey=KFSAVNQQBAZFIP-UHFFFAOYSA-N

SMILES

C(#N)C1=CC=C(C=C1)C=2NN=NN2

Canonical SMILES

N#CC=1C=CC(=CC1)C2=NN=NN2

Other Names for this Substance

  • Benzonitrile, 4-(2H-tetrazol-5-yl)-
  • Benzonitrile, p-1H-tetrazol-5-yl-
  • Benzonitrile, 4-(1H-tetrazol-5-yl)-
  • Benzonitrile, p-tetrazol-5-yl-
  • 4-(2H-Tetrazol-5-yl)benzonitrile

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