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3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-amine

  • CAS No. 126417-82-1

  • Cat. No. CS-0308312
  • Molecule weight207.66
  • Purity95+%
  • MDL No.None

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

3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-amine|CS-0308312

Structure of 126417-82-1

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General Information

  • CAS No. 126417-82-1
  • Cat. No. CS-0308312
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀ClN₃
  • Molecular Weight 207.66
  • Synonym(s) 5-Amino-3-(p-chlorphenyl)-1-methyl-pyrazol
  • SMILES CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)N

Synthesis

  • Route1

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2004/785 A2, 2003 ; Location in patent: Page 22 ; WO 2004/000785 A2
  • Route2
    • 3-Chloro-3-(4-chlorophenyl)-2-propenenitrile|CS-0647594
      78583-86-5
    • null|null
      60-34-4
    • ~27%
    • 3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-amine|CS-0308312
      126417-82-1
    • null|null
      120698-01-3

    References

    • Pharmazie, , vol. 44, # 8 p. 535 - 539
  • Route3
    • null|null
      99-91-2
    • ~%
    • 3-(4-Chlorophenyl)-1-methyl-1H-pyrazol-5-amine|CS-0308312
      126417-82-1

    References

    • Pharmazie, , vol. 44, # 8 p. 535 - 539

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.84
  • LogP   2.3227
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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