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CS-W001157 4
Total: USD 88.00

3-Butyl-2-cyclohexen-1-one

  • CAS No. 6301-49-1

  • Cat. No. CS-0098540
  • Purity≥98%
  • MDL No.MFCD19301004

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

3-Butyl-2-cyclohexen-1-one|CS-0098540

Structure of 6301-49-1

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General Information

  • CAS No. 6301-49-1
  • Cat. No. CS-0098540
  • Purity ≥98%
  • MDL No. MFCD19301004
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₆O
  • Molecular Weight 152.23
  • Synonym(s) 3-Butylcyclohex-2-en-1-one
  • SMILES O=C1C=C(CCCC)CCC1

Synthesis

  • Route1
    • null|null
      88116-46-5
    • ~94%
    • 3-Butyl-2-cyclohexen-1-one|CS-0098540
      6301-49-1

    References

    • Shibuya, Masatoshi; Tomizawa, Masaki; Iwabuchi, Yoshiharu Organic Letters, 2008 , vol. 10, # 21 p. 4715 - 4718
  • Route2

    References

    • Hungerford, Natasha L.; Kitching, William Journal of the Chemical Society - Perkin Transactions 1, 1998 , # 11 p. 1839 - 1858
  • Route3
    • null|null
      1352617-27-6
    • ~89%
    • 3-Butyl-2-cyclohexen-1-one|CS-0098540
      6301-49-1

    References

    • Hayashi, Masaki; Shibuya, Masatoshi; Iwabuchi, Yoshiharu Organic Letters, 2012 , vol. 14, # 1 p. 154 - 157

Safety Information

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.856
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   3

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