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CS-W001157 4
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1-(4-Chloro-2-methoxyphenyl)ethan-1-one

  • CAS No. 60207-19-4

  • Cat. No. CS-0251974
  • Purity≥97%
  • MDL No.None

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

1-(4-Chloro-2-methoxyphenyl)ethan-1-one|CS-0251974

Structure of 60207-19-4

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General Information

  • CAS No. 60207-19-4
  • Cat. No. CS-0251974
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉ClO₂
  • Molecular Weight 184.62
  • Synonym(s) 1-(4-Chloro-2-methoxyphenyl)ethanone
  • SMILES CC(=O)C1=C(C=C(C=C1)Cl)OC

Description

1-(4-Chloro-2-methoxyphenyl)ethan-1-one features a chlorinated aromatic ring paired with a methoxy group, delivering enhanced solubility and stability. This ketone integrates readily into synthetic routes requiring electron-deficient aryl motifs. Its bench-stable nature supports reliable use in multi-step transformations.

Application

1-(4-Chloro-2-methoxyphenyl)ethan-1-one serves as a versatile building block in medicinal chemistry, enabling efficient construction of biologically relevant scaffolds. Its aryl ketone functionality exhibits robust stability under standard synthetic conditions and tolerates diverse reaction environments. The molecule facilitates Friedel–Crafts acylations, nucleophilic additions, and transition-metal-catalyzed couplings, making it valuable for synthesizing complex heterocycles and drug candidates.

Synthesis

  • Route1

    References

    • ABBOTT LABORATORIES Patent: WO2004/76424 A1, 2004 ; Location in patent: Page 80-81 ; WO 2004/076424 A1
  • Route2
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      1-(4-Chloro-2-methoxyphenyl)ethan-1-one|CS-0251974
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    References

    • Lynch, John K.; Freeman, Jennifer C.; Judd, Andrew S.; Iyengar, Rajesh; Mulhern, Mathew; Zhao, Gang; Napier, James J.; Wodka, Dariusz; Brodjian, Sevan; Dayton, Brian D.; Falls, Doug; Ogiela, Christopher; Reilly, Regina M.; Campbell, Thomas J.; Polakowski, James S.; Hernandez, Lisa; Marsh, Kennan C.; Shapiro, Robin; Knourek-Segel, Victoria; Droz, Brian; Bush, Eugene; Brune, Michael; Preusser, Lee C.; Fryer, Ryan M.; Reinhart, Glenn A.; Houseman, Kathryn; Diaz, Gilbert; Mikhail, Ann; Limberis, James T.; Sham, Hing L.; Collins, Christine A.; Kym, Philip R. Journal of Medicinal Chemistry, 2006 , vol. 49, # 22 p. 6569 - 6584
  • Route3
    • In-stock
      1-(4-Chloro-2-hydroxyphenyl)ethan-1-one|CS-0040210
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      1-(4-Chloro-2-methoxyphenyl)ethan-1-one|CS-0251974
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    References

    • The Boots Company PLC Patent: US5547972 A1, 1996 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.5512
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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