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CS-W001157 4
Total: USD 88.00

Ethyl 2-(4-cyano-1H-1,2,3-triazol-1-yl)acetate

  • CAS No. 202003-10-9

  • Cat. No. CS-0333680
  • Molecule weight180.16
  • Purity95+%
  • MDL No.None

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

Ethyl 2-(4-cyano-1H-1,2,3-triazol-1-yl)acetate|CS-0333680

Structure of 202003-10-9

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General Information

  • CAS No. 202003-10-9
  • Cat. No. CS-0333680
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₄O₂
  • Molecular Weight 180.16
  • Synonym(s) Ethyl (4-cyano-1H-1,2,3-triazol-1-yl)acetate
  • SMILES CCOC(=O)CN1C=C(C#N)N=N1

Synthesis

  • Route1
    • null|null
      637-81-0
    • null|null
      64-17-5
    • null|null
      920-37-6
    • ~25%
    • Ethyl 2-(4-cyano-1H-1,2,3-triazol-1-yl)acetate|CS-0333680
      202003-10-9

    References

    • BAYER SCHERING PHARMA AKTIENGESELLSCHAFT Patent: US2010/305085 A1, 2010 ; Location in patent: Page/Page column 26 ; US 20100305085 A1
  • Route2
    • null|null
      637-81-0
    • null|null
      920-37-6
    • ~%
    • Ethyl 2-(4-cyano-1H-1,2,3-triazol-1-yl)acetate|CS-0333680
      202003-10-9

    References

    • Novartis AG Patent: US6156907 A1, 2000 ;
  • Route3
    • null|null
      637-81-0
    • null|null
      7664-93-9
    • null|null
      920-37-6
    • ~%
    • Ethyl 2-(4-cyano-1H-1,2,3-triazol-1-yl)acetate|CS-0333680
      202003-10-9

    References

    • BAYER SCHERING PHARMA AKTIENGESELLSCHAFT Patent: US2009/269420 A1, 2009 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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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   80.8
  • LogP   -0.28712
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   3

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