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CS-W001157 4
Total: USD 88.00

Ethyl 4-cyclopentyl-3-oxobutanoate

  • CAS No. 68104-99-4

  • Cat. No. CS-0122117
  • Molecule weight198.26
  • Purity≥98%
  • MDL No.MFCD03844431

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

Ethyl 4-cyclopentyl-3-oxobutanoate|CS-0122117

Structure of 68104-99-4

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General Information

  • CAS No. 68104-99-4
  • Cat. No. CS-0122117
  • Purity ≥98%
  • MDL No. MFCD03844431
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈O₃
  • Molecular Weight 198.26
  • Synonym(s) 4-CYCLOPENTYL-3-OXO-BUTYRIC ACID ETHYL ESTER
  • SMILES O=C(OCC)CC(CC1CCCC1)=O

Synthesis

  • Route1
    • null|null
      91085-14-2
    • ~77%
    • Ethyl 4-cyclopentyl-3-oxobutanoate|CS-0122117
      68104-99-4

    References

    • Cane; Thomas Journal of the American Chemical Society, 1984 , vol. 106, # 18 p. 5295 - 5303
  • Route2

    References

    • Lager, Erik; Nilsson, Jakob; stergaard Nielsen, Elsebet; Nielsen, Mogens; Liljefors, Tommy; Sterner, Olov Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 14 p. 6936 - 6948
  • Route3

    References

    • Journal of the American Chemical Society, , vol. 106, # 18 p. 5295 - 5303

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-H315-H319
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.089
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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