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CS-W001157 4
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4-Amino-1-methyl-4H-1,2,4-triazol-1-ium nitrate

  • CAS No. 817177-66-5

  • Cat. No. CS-0186932
  • Purity≥97%
  • MDL No.None

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

4-Amino-1-methyl-4H-1,2,4-triazol-1-ium nitrate|CS-0186932

Structure of 817177-66-5

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General Information

  • CAS No. 817177-66-5
  • Cat. No. CS-0186932
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₇N₅O₃
  • Molecular Weight 161.12
  • Synonym(s) 4-Amino-1-methyl-1H-1,2,4-triazolium Nitrate
  • SMILES C[N+]1=CN(C=N1)N.[N+](=O)([O-])[O-]

Synthesis

  • Route1
    • 4-Amino-1-methyl-4H-1,2,4-triazol-1-ium iodide|CS-0162826
      39602-93-2
    • ~%
    • 4-Amino-1-methyl-4H-1,2,4-triazol-1-ium nitrate|CS-0186932
      817177-66-5

    References

    • Drake, Greg W.; Hawkins, Tommy; Tollison, Kerri Patent: US7745635 B1, 2010 ; Location in patent: Page/Page column 13 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS03,GHS07
Signal Word : Danger
UN#: 3139
Class : 5.1
Packing Group : Ⅱ
Hazard Statements : H272-H315-H319
Precautionary Statements : P210-P220-P264-P280-P302+P352-P362+P364-P370+P378-P501

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Computational Chemistry Data

  • TPSA   113.92
  • LogP   -1.8177
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   0

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