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CS-W001157 4
Total: USD 88.00

4-Chloro-1-(4-fluorophenyl)butan-1-one

  • CAS No. 3874-54-2

  • Cat. No. CS-W009108
  • Purity≥95%
  • MDL No.MFCD00001007

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

4-Chloro-1-(4-fluorophenyl)butan-1-one|CS-W009108

Structure of 3874-54-2

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General Information

  • CAS No. 3874-54-2
  • Cat. No. CS-W009108
  • Purity ≥95%
  • MDL No. MFCD00001007
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀ClFO
  • Molecular Weight 200.64
  • Synonym(s) gamma-Chloro-p-fluorobutyrophenone
  • SMILES O=C(C1=CC=C(F)C=C1)CCCCl

Description

4-Chloro-1-(4-fluorophenyl)butan-1-one features a fluorinated aryl group paired with a chlorinated aliphatic chain, enabling efficient integration into pharmaceutical intermediates. This electron-deficient ketone serves as a key scaffold for coupling reactions and offers enhanced stability under standard bench conditions.

Synthesis

  • Route1
    • 2-(3-Chloropropyl)-2-(4-fluorophenyl)-1,3-dioxolane|CS-W010259
      3308-94-9
    • ~87%
    • In-stock
      4-Chloro-1-(4-fluorophenyl)butan-1-one|CS-W009108
      3874-54-2

    References

    • Gregg, Brian T.; Golden, Kathryn C.; Quinn, John F. Journal of Organic Chemistry, 2007 , vol. 72, # 15 p. 5890 - 5893
  • Route2
    • null|null
      462-06-6
    • In-stock
      4-Chlorobutyryl chloride|CS-0018490
      4635-59-0
    • ~73%
    • In-stock
      4-Chloro-1-(4-fluorophenyl)butan-1-one|CS-W009108
      3874-54-2

    References

    • Schliemann; Buege; Reppel Pharmazie, 1980 , vol. 35, # 3 p. 140 - 143
  • Route3
    • null|null
      352-13-6
    • In-stock
      4-Chlorobutyryl chloride|CS-0018490
      4635-59-0
    • ~89%
    • In-stock
      4-Chloro-1-(4-fluorophenyl)butan-1-one|CS-W009108
      3874-54-2

    References

    • Gowda, Maravanhalli Sidde; Pande, Sushanth Sudhir; Ramakrishna, Ramesha Andagar; Prabhu, Kandikere Ramaiah Organic and Biomolecular Chemistry, 2011 , vol. 9, # 15 p. 5365 - 5368

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3082
Class : 9
Packing Group : Ⅲ
Hazard Statements : H227-H317-H411
Precautionary Statements : P210-P261-P272-P273-P280-P302+P352-P363-P370+P378-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.0274
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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