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Ethyl 2-cyclopentylidene-2-fluoroacetate

  • CAS No. 113307-25-8

  • Cat. No. CS-0347797
  • Molecule weight172.20
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-cyclopentylidene-2-fluoroacetate|CS-0347797

Structure of 113307-25-8

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General Information

  • CAS No. 113307-25-8
  • Cat. No. CS-0347797
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₃FO₂
  • Molecular Weight 172.20
  • Synonym(s) None
  • SMILES O=C(OCC)C(F)=C1CCCC1

Synthesis

  • Route1

    References

    • Van Der Veken, Pieter; Senten, Kristel; Kertesz, Istvan; De Meester, Ingrid; Lambeir, Anne-Marie; Maes, Marie-Berthe; Scharpe, Simon; Haemers, Achiel; Augustyns, Koen Journal of Medicinal Chemistry, 2005 , vol. 48, # 6 p. 1768 - 1780
  • Route2
    • null|null
      864363-39-3
    • ~60%
    • null|null
      1666-13-3
    • Ethyl 2-cyclopentylidene-2-fluoroacetate|CS-0347797
      113307-25-8

    References

    • Yoshimatsu, Mitsuhiro; Murase, Yoshinori; Itoh, Akinori; Tanabe, Genzoh; Muraoka, Osamu Chemistry Letters, 2005 , vol. 34, # 7 p. 998 - 999
  • Route3
    • null|null
      120-92-3
    • ~%
    • Ethyl 2-cyclopentylidene-2-fluoroacetate|CS-0347797
      113307-25-8

    References

    • Pellicciari, Roberto; Natalini, Benedetto; Sadeghpour, Bahman M.; Marinozzi, Maura; Snyder, James P.; Williamson, Bobby L.; Kuethe, Jeffrey T.; Padwa, Albert Journal of the American Chemical Society, 1996 , vol. 118, # 1 p. 1 - 12

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

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.3471
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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