5-(4-Bromophenyl)-1H-1,2,4-triazole

CAS Registry Number®

118863-62-0
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CAS Name

5-(4-Bromophenyl)-1H-1,2,4-triazole

Molecular Formula

C8H6BrN3

Molecular Mass

224.06

Cite this Page

5-(4-Bromophenyl)-1H-1,2,4-triazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=118863-62-0 (retrieved 2024-04-28) (CAS RN: 118863-62-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=XJSPWQRTWATLKK-UHFFFAOYSA-N

SMILES

BrC1=CC=C(C=C1)C=2NC=NN2

Canonical SMILES

BrC=1C=CC(=CC1)C2=NN=CN2

Other Names for this Substance

  • 1H-1,2,4-Triazole, 5-(4-bromophenyl)-
  • 1H-1,2,4-Triazole, 3-(4-bromophenyl)-
  • 5-(4-Bromophenyl)-1H-1,2,4-triazole
  • 3-(4-Bromophenyl)-1H-1,2,4-triazole
  • 3-(4-Bromophenyl)-4H-1,2,4-triazole

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