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5-(p-Tolyl)-1,3,4-thiadiazole-2(3H)-thione

  • CAS No. 85103-31-7

  • Cat. No. CS-0162935
  • Purity≥97%
  • MDL No.None

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

5-(p-Tolyl)-1,3,4-thiadiazole-2(3H)-thione|CS-0162935

Structure of 85103-31-7

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General Information

  • CAS No. 85103-31-7
  • Cat. No. CS-0162935
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂S₂
  • Molecular Weight 208.30
  • Synonym(s) 5-BENZYL-1,3,4-THIADIAZOLE-2-THIOL
  • SMILES S=C1SC(C2=CC=C(C)C=C2)=NN1

Synthesis

  • Route1
    • null|null
      38499-94-4
    • ~%
    • 5-(p-Tolyl)-1,3,4-thiadiazole-2(3H)-thione|CS-0162935
      85103-31-7

    References

    • Aliano; Allen; Brown; et al. Australian Journal of Chemistry, 1984 , vol. 37, # 11 p. 2385 - 2390
  • Route2

    References

    • Aliano; Allen; Brown; et al. Australian Journal of Chemistry, 1984 , vol. 37, # 11 p. 2385 - 2390

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   28.68
  • LogP   3.17611
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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