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Benzyl 5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate

  • CAS No. 913376-49-5

  • Cat. No. CS-0457874
  • Molecule weight308.33
  • Purity≥98%
  • MDL No.None

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

Benzyl 5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate|CS-0457874

Structure of 913376-49-5

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General Information

  • CAS No. 913376-49-5
  • Cat. No. CS-0457874
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₆N₂O₃
  • Molecular Weight 308.33
  • Synonym(s) benzyl 5-Methyl-3-oxo-2-phenyl-2.3-dihydro-1H-pyrazole-4-carboxy
  • SMILES O=C(C1=C(C)NN(C2=CC=CC=C2)C1=O)OCC3=CC=CC=C3

Synthesis

  • Route1
    • null|null
      501-53-1
    • ~80%
    • Benzyl 5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxylate|CS-0457874
      913376-49-5

    References

    • Amgen Inc. Patent: WO2006/116713 A1, 2006 ; Location in patent: Page/Page column 116 ; WO 2006/116713 A1
  • Route2

    References

    • AMGEN INC. Patent: WO2008/86014 A2, 2008 ; Location in patent: Page/Page column 55 ;

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   64.09
  • LogP   2.83102
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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