5-(4H-1,2,4-Triazol-4-yl)-1H-1,2,4-triazole

CAS Registry Number®

68984-29-2
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CAS Name

5-(4H-1,2,4-Triazol-4-yl)-1H-1,2,4-triazole

Molecular Formula

C4H4N6

Molecular Mass

136.11

Cite this Page

5-(4H-1,2,4-Triazol-4-yl)-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=68984-29-2 (retrieved 2024-07-07) (CAS RN: 68984-29-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    300-302 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C4H4N6/c1-5-4(9-6-1)10-2-7-8-3-10/h1-3H,(H,5,6,9)

InChIKey

InChIKey=LUSKRWPZZNTOPG-UHFFFAOYSA-N

SMILES

C=1(NC=NN1)N2C=NN=C2

Canonical SMILES

N=1N=CN(C1)C2=NN=CN2

Other Names for this Substance

  • 1H-1,2,4-Triazole, 5-(4H-1,2,4-triazol-4-yl)-
  • 3,4′-Bi-4H-1,2,4-triazole
  • s-Triazole, 3-(4H-1,2,4-triazol-4-yl)-
  • 5-(4H-1,2,4-Triazol-4-yl)-1H-1,2,4-triazole
  • BITA

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Deleted or Replaced CAS Registry Numbers

182763-39-9, 174127-25-4