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Methyl 2-cyclohexylideneacetate

  • CAS No. 40203-74-5

  • Cat. No. CS-0511944
  • Purity≥98%
  • MDL No.MFCD09866830

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

Methyl 2-cyclohexylideneacetate|CS-0511944

Structure of 40203-74-5

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General Information

  • CAS No. 40203-74-5
  • Cat. No. CS-0511944
  • Purity ≥98%
  • MDL No. MFCD09866830
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₂
  • Molecular Weight 154.21
  • Synonym(s) Cyclohexylideneacetic acid methyl ester
  • SMILES O=C(OC)C=C1CCCCC1

Synthesis

  • Route1

    References

    • Kapferer, Tobias; Brueckner, Reinhard European Journal of Organic Chemistry, 2006 , # 9 p. 2119 - 2133
  • Route2

    References

    • ARETE THERAPEUTICS, INC. Patent: WO2008/73623 A2, 2008 ; Location in patent: Page/Page column 93 ;
  • Route3
    • null|null
      116-54-1
    • null|null
      108-94-1
    • ~67%
    • Methyl 2-cyclohexylideneacetate|CS-0511944
      40203-74-5

    References

    • Ishino, Yoshio; Mihara, Masatoshi; Nishihama, Shintaro; Nishiguchi, Ikuzou Bulletin of the Chemical Society of Japan, 1998 , vol. 71, # 11 p. 2669 - 2672

Safety Information

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Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.0499
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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