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CS-W001157 4
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3-Propyl-4,5-dihydro-1h-pyrazol-5-one

  • CAS No. 29211-70-9

  • Cat. No. CS-0215888
  • Purity95+%
  • MDL No.None

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

3-Propyl-4,5-dihydro-1h-pyrazol-5-one|CS-0215888

Structure of 29211-70-9

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General Information

  • CAS No. 29211-70-9
  • Cat. No. CS-0215888
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₂O
  • Molecular Weight 126.16
  • Synonym(s) 3-n-Propyl-2-pyrazolin-5-one
  • SMILES CCCC1=NNC(C1)=O

Synthesis

  • Route1

    References

    • Takeda San Diego, Inc. Patent: US2006/41137 A1, 2006 ; Location in patent: Page/Page column 39 ; US 20060041137 A1
  • Route2

    References

    • Mojtahedi, Mohammad M.; Jalali, Mohammad R.; Saeed Abaee; Bolourtchian, Mohammad Heterocyclic Communications, 2006 , vol. 12, # 3-4 p. 225 - 228

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

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Computational Chemistry Data

  • TPSA   41.46
  • LogP   0.6624
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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