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CS-W001157 4
Total: USD 88.00

1-Cyclohexylethanone

  • CAS No. 823-76-7

  • Cat. No. CS-W007597
  • Purity≥97%
  • MDL No.None

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

1-Cyclohexylethanone|CS-W007597

Structure of 823-76-7

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General Information

  • CAS No. 823-76-7
  • Cat. No. CS-W007597
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O
  • Molecular Weight 126.20
  • Synonym(s) Cyclohexyl methyl ketone
  • SMILES CC(C1CCCCC1)=O

Description

1-Cyclohexylethanone is a bench-stable ketone featuring a cyclohexyl ring directly attached to a carbonyl-bearing ethyl group. This structure delivers enhanced solubility in organic media and stability under standard reaction conditions, making it ideal for use in synthetic transformations involving nucleophilic addition or enolate chemistry.

Application

1-Cyclohexylethanone serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized cyclohexane derivatives. Its ketone functionality facilitates nucleophilic additions, enolate formation, and subsequent transformations such as α-alkylation or reduction. The molecule exhibits excellent bench stability and compatibility with common protecting group strategies, making it a practical choice for multi-step synthesis and heterocycle construction.

Synthesis

  • Route1

    References

    • Kim, Won-Hee; Park, In Soo; Park, Jaiwook Organic Letters, 2006 , vol. 8, # 12 p. 2543 - 2545
  • Route2
    • Ethynylcyclohexane|CS-W022720
      931-48-6
    • ~94%
    • In-stock
      1-Cyclohexylethanone|CS-W007597
      823-76-7

    References

    • Chen, Zheng-Wang; Ye, Dong-Nai; Qian, Yi-Ping; Ye, Min; Liu, Liang-Xian Tetrahedron, 2013 , vol. 69, # 30 p. 6116 - 6120
  • Route3
    • null|null
      917-54-4
    • In-stock
      N-Methoxy-N-methylcyclohexanecarboxamide|CS-0048810
      80783-98-8
    • ~94%
    • In-stock
      1-Cyclohexylethanone|CS-W007597
      823-76-7

    References

    • Chapal, Nicolas; McNicol, Patricia; Jette, Lucie Patent: US2006/223884 A1, 2006 ; Location in patent: Page/Page column 56 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.1557
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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