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CS-W001157 4
Total: USD 88.00

4-(4-Fluorophenyl)cyclohexan-1-one

  • CAS No. 40503-86-4

  • Cat. No. CS-0308692
  • Purity≥97%
  • MDL No.None

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

4-(4-Fluorophenyl)cyclohexan-1-one|CS-0308692

Structure of 40503-86-4

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General Information

  • CAS No. 40503-86-4
  • Cat. No. CS-0308692
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃FO
  • Molecular Weight 192.23
  • Synonym(s) 4-(4-Fluorophenyl)cyclohexanone
  • SMILES C1=C(C=CC(=C1)F)C2CCC(=O)CC2

Synthesis

  • Route1
    • 4-Fluoro-2,5-dihydro-[1,1-biphenyl]-4(3H)-one|CS-0964053
      36716-73-1
    • ~88%
    • 4-(4-Fluorophenyl)cyclohexan-1-one|CS-0308692
      40503-86-4

    References

    • WARNER-LAMBERT COMPANY Patent: EP1251128 A1, 2002 ; Location in patent: Page 40 ; EP 1251128 A1
  • Route2
    • 8-(4-Fluorophenyl)-1,4-dioxaspiro[4.5]decane|CS-1211902
      80912-56-7
    • ~86%
    • 4-(4-Fluorophenyl)cyclohexan-1-one|CS-0308692
      40503-86-4

    References

    • Bristol-Myers Squibb Co. Patent: US5352678 A1, 1994 ; US 5352678 A
  • Route3
    • 8-(4-Fluorophenyl)-1,4-dioxaspiro[4.5]Decan-8-ol|CS-0487420
      122770-39-2
    • ~76%
    • 4-(4-Fluorophenyl)cyclohexan-1-one|CS-0308692
      40503-86-4

    References

    • Pfizer Inc. Patent: US5484917 A1, 1996 ; US 5484917 A

Safety Information

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

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.0524
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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