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1-(Furan-2-yl)heptan-1-one

  • CAS No. 5466-40-0

  • Cat. No. CS-0535652
  • Molecule weight180.24
  • Purity≥98%
  • MDL No.None

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

1-(Furan-2-yl)heptan-1-one|CS-0535652

Structure of 5466-40-0

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General Information

  • CAS No. 5466-40-0
  • Cat. No. CS-0535652
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆O₂
  • Molecular Weight 180.24
  • Synonym(s) 2-Heptanoylfuran
  • SMILES CCCCCCC(=O)C1=CC=CO1

Synthesis

  • Route1
    • null|null
      110-00-9
    • null|null
      67132-63-2
    • ~99%
    • 1-(Furan-2-yl)heptan-1-one|CS-0535652
      5466-40-0

    References

    • Kozikowski, Alan P.; Ames, Anthony Journal of the American Chemical Society, 1980 , vol. 102, # 2 p. 860 - 862
  • Route2
    • null|null
      22721-97-7
    • ~63%
    • 1-(Furan-2-yl)heptan-1-one|CS-0535652
      5466-40-0

    References

    • Miyakoshi, Tetsuo; Togashi, Hiroyasu Synthesis, 1990 , # 5 p. 407 - 410
  • Route3
    • null|null
      110-00-9
    • null|null
      111-14-8
    • null|null
      541-88-8
    • ~91%
    • 1-(Furan-2-yl)heptan-1-one|CS-0535652
      5466-40-0

    References

    • Sumitomo Chemical Company, Limited Patent: US4812585 A1, 1989 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   30.21
  • LogP   3.4327
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   6

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