5-Bromo-1-phenyl-1H-1,2,4-triazole

CAS Registry Number®

21434-15-1
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CAS Name

5-Bromo-1-phenyl-1H-1,2,4-triazole

Molecular Formula

C8H6BrN3

Molecular Mass

224.06

Cite this Page

5-Bromo-1-phenyl-1H-1,2,4-triazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21434-15-1 (retrieved 2024-08-12) (CAS RN: 21434-15-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    89-90 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6BrN3/c9-8-10-6-11-12(8)7-4-2-1-3-5-7/h1-6H

InChIKey

InChIKey=VVKRUJQGEZCXRQ-UHFFFAOYSA-N

SMILES

BrC=1N(N=CN1)C2=CC=CC=C2

Canonical SMILES

BrC1=NC=NN1C=2C=CC=CC2

Other Names for this Substance

  • 1H-1,2,4-Triazole, 5-bromo-1-phenyl-
  • 5-Bromo-1-phenyl-1H-1,2,4-triazole
  • 1-Phenyl-5-bromo-1,2,4-triazole