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CS-W001157 4
Total: USD 88.00

3-(Prop-2-yn-1-yl)pentane-2,4-dione

  • CAS No. 38352-74-8

  • Cat. No. CS-0229892
  • Purity≥95%
  • MDL No.None

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

3-(Prop-2-yn-1-yl)pentane-2,4-dione|CS-0229892

Structure of 38352-74-8

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General Information

  • CAS No. 38352-74-8
  • Cat. No. CS-0229892
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀O₂
  • Molecular Weight 138.16
  • Synonym(s) 3-propargylpentane-2,4-dione
  • SMILES CC(C(CC#C)C(C)=O)=O

Synthesis

  • Route1
    • null|null
      106-96-7
    • null|null
      123-54-6
    • ~69%
    • 3-(Prop-2-yn-1-yl)pentane-2,4-dione|CS-0229892
      38352-74-8

    References

    • Lenhart, James A.; Ling, Xiao; Gandhi, Ronak; Guo, Tai L.; Gerk, Phillip M.; Brunzell, Darlene H.; Zhang, Shijun Journal of Medicinal Chemistry, 2010 , vol. 53, # 16 p. 6198 - 6209
  • Route2
    • null|null
      2003-82-9
    • null|null
      123-54-6
    • ~%
    • 3-(Prop-2-yn-1-yl)pentane-2,4-dione|CS-0229892
      38352-74-8

    References

    • Brown,D.J.; England,B.T. Journal of the Chemical Society [Section] C: Organic, 1967 , p. 1922 - 1927

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H227-H315-H318-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P370+P378-P403+P233-P403+P235-P405-P501

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   0.8039
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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