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4-Allyl-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol

  • CAS No. 187795-50-2

  • Cat. No. CS-0308195
  • Purity95+%
  • MDL No.None

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

4-Allyl-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol|CS-0308195

Structure of 187795-50-2

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General Information

  • CAS No. 187795-50-2
  • Cat. No. CS-0308195
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉N₃S₂
  • Molecular Weight 223.32
  • Synonym(s) 4-allyl-5-thien-2-yl-4H-1,2,4-triazole-3-thiol
  • SMILES C=CCN1C(=NN=C1S)C2=CC=CS2

Synthesis

  • Route1

    References

    • Koparir, Metin; Orek, Cahit; Parlak, Akif Evren; Soeylemez, Abdurrazak; Koparir, Pelin; Karatepe, Mustafa; Dastan, Sevgi Durna European Journal of Medicinal Chemistry, 2013 , vol. 63, p. 340 - 346

Safety Information

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

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Computational Chemistry Data

  • TPSA   30.71
  • LogP   2.4813
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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