5-Phenyltetrazole

CAS Registry Number®

18039-42-4

CAS Name

5-Phenyltetrazole

Molecular Formula

C7H6N4

Molecular Mass

146.15

Cite this Page

5-Phenyltetrazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18039-42-4 (retrieved 2024-10-05) (CAS RN: 18039-42-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    40-60 °C

  • Melting Point (2)

    215 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H6N4/c1-2-4-6(5-3-1)7-8-10-11-9-7/h1-5H,(H,8,9,10,11)

InChIKey

InChIKey=MARUHZGHZWCEQU-UHFFFAOYSA-N

SMILES

C=1(NN=NN1)C2=CC=CC=C2

Canonical SMILES

N1=NNC(=N1)C=2C=CC=CC2

Other Names for this Substance

  • 2H-Tetrazole, 5-phenyl-
  • 1H-Tetrazole, 5-phenyl-
  • Tetrazole, 5-phenyl-
  • 5-Phenyl-2H-tetrazole
  • 5-Phenyltetrazole

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Deleted or Replaced CAS Registry Numbers

3999-10-8, 25378-28-3, 31422-49-8, 221658-40-8, 133585-63-4

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