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N-Benzyl-3-(methylsulfanyl)-1h-1,2,4-triazol-5-amine

  • CAS No. 88722-37-6

  • Cat. No. CS-0127432
  • Purity≥98%
  • MDL No.MFCD10699108

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

N-Benzyl-3-(methylsulfanyl)-1h-1,2,4-triazol-5-amine|CS-0127432

Structure of 88722-37-6

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General Information

  • CAS No. 88722-37-6
  • Cat. No. CS-0127432
  • Purity ≥98%
  • MDL No. MFCD10699108
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₄S
  • Molecular Weight 220.29
  • Synonym(s) 1H-1,2,4-Triazol-3-amine, 5-(methylthio)-N-(phenylmethyl)-
  • SMILES CSC1=NNC(NCC2=CC=CC=C2)=N1

Synthesis

  • Route1
    • In-stock
      5-(Methylthio)-1H-1,2,4-triazol-3-amine|CS-0063193
      45534-08-5
    • ~2%
    • null|null
      88722-36-5
    • null|null
      84827-84-9
    • N-Benzyl-3-(methylsulfanyl)-1h-1,2,4-triazol-5-amine|CS-0127432
      88722-37-6
    • null|null
      84827-85-0

    References

    • Reiter, J.; Somorai, T.; Dvortsak, P.; Bujtas, Gy. Journal of Heterocyclic Chemistry, 1985 , vol. 22, p. 385 - 394

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   53.6
  • LogP   2.1387
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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