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CS-W001157 4
Total: USD 88.00

Ethyl 5-amino-1-(4-bromophenyl)-4-cyanopyrazole-3-carboxylate

  • CAS No. 96723-27-2

  • Cat. No. CS-0212277
  • Purity≥98%
  • MDL No.MFCD09835740

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

Ethyl 5-amino-1-(4-bromophenyl)-4-cyanopyrazole-3-carboxylate|CS-0212277

Structure of 96723-27-2

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General Information

  • CAS No. 96723-27-2
  • Cat. No. CS-0212277
  • Purity ≥98%
  • MDL No. MFCD09835740
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁BrN₄O₂
  • Molecular Weight 335.16
  • Synonym(s) Ethyl5-amino-1-(4-bromophenyl)-4-cyanopyrazole-3-carboxylate
  • SMILES CCOC(=O)C1=NN(C2=CC=C(C=C2)Br)C(=C1C#N)N

Synthesis

  • Route1
    • Ethyl (2Z)-2-[2-(4-bromophenyl)hydrazin-1-ylidene]-2-chloroacetate|CS-0125890
      27143-10-8
    • null|null
      109-77-3
    • ~82%
    • Ethyl 5-amino-1-(4-bromophenyl)-4-cyanopyrazole-3-carboxylate|CS-0212277
      96723-27-2

    References

    • Bernard; Cocco; Maccioni; Plumitallo Farmaco, Edizione Scientifica, 1985 , vol. 40, # 4 p. 259 - 271
  • Route2
    • null|null
      106-40-1
    • ~%
    • Ethyl 5-amino-1-(4-bromophenyl)-4-cyanopyrazole-3-carboxylate|CS-0212277
      96723-27-2

    References

    • Farmaco, Edizione Scientifica, , vol. 40, # 4 p. 259 - 271

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

Quality Control

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Computational Chemistry Data

  • TPSA   93.93
  • LogP   2.26538
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   3

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