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CS-W001157 4
Total: USD 88.00

1-(Furan-2-yl)pentane-1,4-dione

  • CAS No. 52786-29-5

  • Cat. No. CS-0322977
  • Purity≥97%
  • MDL No.None

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

1-(Furan-2-yl)pentane-1,4-dione|CS-0322977

Structure of 52786-29-5

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General Information

  • CAS No. 52786-29-5
  • Cat. No. CS-0322977
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₃
  • Molecular Weight 166.17
  • Synonym(s) 1-(2-FURYL)-1,4-PENTANEDIONE
  • SMILES CC(CCC(C1=CC=CO1)=O)=O

Synthesis

  • Route1
    • null|null
      98-01-1
    • null|null
      78-94-4
    • ~98%
    • 1-(Furan-2-yl)pentane-1,4-dione|CS-0322977
      52786-29-5

    References

    • El-Hajj, Toni; Martin, Jean-Claude; Descotes, Gerard Journal of Heterocyclic Chemistry, 1983 , vol. 20, p. 233 - 235
  • Route2
    • null|null
      14583-98-3
    • null|null
      111886-29-4
    • ~57%
    • 1-(Furan-2-yl)pentane-1,4-dione|CS-0322977
      52786-29-5

    References

    • Kohno, Yasushi; Narasaka, Koichi Bulletin of the Chemical Society of Japan, 1995 , vol. 68, # 1 p. 322 - 329
  • Route3
    • null|null
      946401-60-1
    • ~18%
    • 1-(Furan-2-yl)pentane-1,4-dione|CS-0322977
      52786-29-5
    • null|null
      16303-61-0

    References

    • Pridmore, Simon J.; Slatford, Paul A.; Williams, Jonathan M.J. Tetrahedron Letters, 2007 , vol. 48, # 29 p. 5111 - 5114

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   47.28
  • LogP   1.8315
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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