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CS-W001157 4
Total: USD 88.00

Ethyl (1-benzo-5-amino-1,2,3-triazole)-4-carboxylate

  • CAS No. 20271-33-4

  • Cat. No. CS-0012666
  • Molecule weight246.27
  • Purity≥98%
  • MDL No.MFCD02068900

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

Ethyl (1-benzo-5-amino-1,2,3-triazole)-4-carboxylate|CS-0012666

Structure of 20271-33-4

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General Information

  • CAS No. 20271-33-4
  • Cat. No. CS-0012666
  • Purity ≥98%
  • MDL No. MFCD02068900
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄N₄O₂
  • Molecular Weight 246.27
  • Synonym(s) ethyl 5-amino-1-benzyl-1H-1,2,3-triazole-4-carboxylate
  • SMILES O=C(C1=C(N)N(CC2=CC=CC=C2)N=N1)OCC

Synthesis

  • Route1
    • null|null
      105-56-6
    • null|null
      622-79-7
    • ~51%
    • Ethyl (1-benzo-5-amino-1,2,3-triazole)-4-carboxylate|CS-0012666
      20271-33-4

    References

    • Erashko, V. I.; El'yanova, B. S.; Baryshnikov, A. T.; Zubanova, N. I.; Tishaninova, A. A. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1985 , vol. 34, # 11 p. 2440 - 2441 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1985 , # 11 p. 2633 - 2634
  • Route2
    • null|null
      100-39-0
    • ~58%
    • Ethyl (1-benzo-5-amino-1,2,3-triazole)-4-carboxylate|CS-0012666
      20271-33-4
    • null|null
      622-79-7

    References

    • Abbott Laboratories Patent: US5326776 A1, 1994 ; US 5326776 A
  • Route3
    • null|null
      64-17-5
    • null|null
      141-52-6
    • null|null
      105-56-6
    • null|null
      622-79-7
    • ~%
    • Ethyl (1-benzo-5-amino-1,2,3-triazole)-4-carboxylate|CS-0012666
      20271-33-4

    References

    • Journal of the American Chemical Society, , vol. 78, p. 5832,5835

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   83.03
  • LogP   1.0853
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   4

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