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CS-W001157 4
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1-(3-Methyl-1H-pyrazol-4-yl)ethan-1-one

  • CAS No. 105224-04-2

  • Cat. No. CS-0058347
  • Purity≥98%
  • MDL No.MFCD09035528

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

1-(3-Methyl-1H-pyrazol-4-yl)ethan-1-one|CS-0058347

Structure of 105224-04-2

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General Information

  • CAS No. 105224-04-2
  • Cat. No. CS-0058347
  • Purity ≥98%
  • MDL No. MFCD09035528
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈N₂O
  • Molecular Weight 124.14
  • Synonym(s) 1-(5-Methyl-1H-pyrazol-4-yl)ethanone
  • SMILES CC(C1=CNN=C1C)=O

Synthesis

  • Route1

    References

    • Tarabova, Denisa; Soralova, Stanislava; Breza, Martin; Fronc, Marek; Holzer, Wolfgang; Milata, Viktor Beilstein Journal of Organic Chemistry, 2014 , vol. 10, p. 752 - 760
  • Route2
    • null|null
      153136-98-2
    • ~73%
    • In-stock
      1-(3-Methyl-1H-pyrazol-4-yl)ethan-1-one|CS-0058347
      105224-04-2
    • N'-phenylbenzohydrazide|CS-0317663
      532-96-7

    References

    • Mitkidou, Sophia; Stephanidou-Stephanatou, Julia; Stephopoulou, Helen Journal of Heterocyclic Chemistry, 1993 , vol. 30, # 2 p. 441 - 444
  • Route3

    References

    • Menichi; Boutar; Kokel; et al. Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 1 p. 275 - 279

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

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Computational Chemistry Data

  • TPSA   45.75
  • LogP   0.92072
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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