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CS-W001157 4
Total: USD 88.00

4-Amino-6-phenyl-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one

  • CAS No. 22278-82-6

  • Cat. No. CS-0546923
  • Molecule weight220.25
  • Purity≥98%
  • MDL No.None

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

4-Amino-6-phenyl-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one|CS-0546923

Structure of 22278-82-6

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General Information

  • CAS No. 22278-82-6
  • Cat. No. CS-0546923
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₄OS
  • Molecular Weight 220.25
  • Synonym(s) 4-Amino-3-mercapto-6-phenyl-1,2,4-triazin-5(4H)-one
  • SMILES C1=CC=C(C=C1)C2=NNC(=S)N(C2=O)N

Synthesis

  • Route1
    • null|null
      106119-76-0
    • ~53%
    • 4-Amino-6-phenyl-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one|CS-0546923
      22278-82-6

    References

    • Mironovich; Salistaya; Promonenkov Russian Journal of General Chemistry, 2001 , vol. 71, # 6 p. 991 - 992
  • Route2
    • 3-Mercapto-6-phenyl-1,2,4-triazin-5-ol|CS-0452574
      447-00-7
    • ~%
    • 4-Amino-6-phenyl-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one|CS-0546923
      22278-82-6

    References

    • Mironovich; Salistaya; Promonenkov Russian Journal of General Chemistry, 2001 , vol. 71, # 6 p. 991 - 992

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

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Computational Chemistry Data

  • TPSA   76.7
  • LogP   0.68169
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   1

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