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CS-W001157 4
Total: USD 88.00

2-Phenyl-2,4-dihydro-3H-pyrazol-3-one

  • CAS No. 876-92-6

  • Cat. No. CS-0365066
  • Purity95+%
  • MDL No.None

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

2-Phenyl-2,4-dihydro-3H-pyrazol-3-one|CS-0365066

Structure of 876-92-6

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General Information

  • CAS No. 876-92-6
  • Cat. No. CS-0365066
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O
  • Molecular Weight 160.17
  • Synonym(s) 1-phenyl-1H-pyrazol-5(4H)-one
  • SMILES C1=CC=C(C=C1)N2C(=O)CC=N2

Synthesis

  • Route1
    • null|null
      88585-32-4
    • ~38%
    • 2-Phenyl-2,4-dihydro-3H-pyrazol-3-one|CS-0365066
      876-92-6

    References

    • PFIZER PRODUCTS INC. Patent: WO2008/23235 A1, 2008 ; Location in patent: Page/Page column 30 ;
  • Route2
    • null|null
      25115-90-6
    • ~36%
    • 2-Phenyl-2,4-dihydro-3H-pyrazol-3-one|CS-0365066
      876-92-6

    References

    • Sanofi Patent: US5750550 A1, 1998 ;
  • Route3
    • null|null
      706819-80-9
    • ~72%
    • 2-Phenyl-2,4-dihydro-3H-pyrazol-3-one|CS-0365066
      876-92-6

    References

    • Guillou, Sandrine; Janin, Yves L. Chemistry - A European Journal, 2010 , vol. 16, # 15 p. 4669 - 4677

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   32.67
  • LogP   1.4091
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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