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CS-W001157 4
Total: USD 88.00

3-(Methylthio)-1-phenyl-1H-1,2,4-triazol-5-amine

  • CAS No. 82117-98-4

  • Cat. No. CS-0563725
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-(Methylthio)-1-phenyl-1H-1,2,4-triazol-5-amine|CS-0563725

Structure of 82117-98-4

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General Information

  • CAS No. 82117-98-4
  • Cat. No. CS-0563725
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₄S
  • Molecular Weight 206.27
  • Synonym(s) 5-methylsulfanyl-2-phenyl-2H-[1,2,4]triazol-3-ylamine
  • SMILES CSC1=NN(C(=N1)N)C2=CC=CC=C2

Synthesis

  • Route1
    • null|null
      100-63-0
    • In-stock
      Dimethyl cyanocarbonimidodithioate|CS-W018225
      10191-60-3
    • ~82%
    • null|null
      58610-23-4
    • 3-(Methylthio)-1-phenyl-1H-1,2,4-triazol-5-amine|CS-0563725
      82117-98-4

    References

    • Reiter, J.; Somorai, T.; Jerkovich, Gy.; Dvortsak, P. Journal of Heterocyclic Chemistry, 1982 , vol. 19, p. 1157 - 1164
  • Route2
    • null|null
      73491-54-0
    • null|null
      100-63-0
    • ~85%
    • 3-(Methylthio)-1-phenyl-1H-1,2,4-triazol-5-amine|CS-0563725
      82117-98-4

    References

    • Evers, R.; Fischer, E. Journal fuer Praktische Chemie (Leipzig), 1985 , vol. 327, # 4 p. 609 - 615
  • Route3
    • null|null
      100-63-0
    • ~%
    • 3-(Methylthio)-1-phenyl-1H-1,2,4-triazol-5-amine|CS-0563725
      82117-98-4

    References

    • Fromm; Kapeller-Adler Justus Liebigs Annalen der Chemie, 1928 , vol. 467, p. 254

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   56.73
  • LogP   1.5714
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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