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CS-W001157 4
Total: USD 88.00

3-(2-Methylpropyl)-2-cyclohexen-1-one

  • CAS No. 6301-50-4

  • Cat. No. CS-0098539
  • Purity≥98%
  • MDL No.MFCD03412403

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

3-(2-Methylpropyl)-2-cyclohexen-1-one|CS-0098539

Structure of 6301-50-4

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General Information

  • CAS No. 6301-50-4
  • Cat. No. CS-0098539
  • Purity ≥98%
  • MDL No. MFCD03412403
  • 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-(2-Methylpropyl)cyclohex-2-en-1-one
  • SMILES O=C1C=C(CC(C)C)CCC1

Synthesis

  • Route1

    References

    • Martin, Nolwenn J. A.; List, Benjamin Journal of the American Chemical Society, 2006 , vol. 128, # 41 p. 13368 - 13369
  • Route2
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      29179-03-1
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      75-16-1
    • ~%
    • 3-(2-Methylpropyl)-2-cyclohexen-1-one|CS-0098539
      6301-50-4

    References

    • Henon, Helene; Mauduit, Marc; Alexakis, Alexandre Angewandte Chemie - International Edition, 2008 , vol. 47, # 47 p. 9122 - 9124
  • Route3

    References

    • Scheuermann Nee Taylor, Caroline J.; Jaekel, Christoph Advanced Synthesis and Catalysis, 2008 , vol. 350, # 17 p. 2708 - 2714

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.7119
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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