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CS-W001157 4
Total: USD 88.00

1-(4,5-Dichloro-2-hydroxyphenyl)ethan-1-one

  • CAS No. 22526-30-3

  • Cat. No. CS-0133076
  • Purity≥95%
  • MDL No.None

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

1-(4,5-Dichloro-2-hydroxyphenyl)ethan-1-one|CS-0133076

Structure of 22526-30-3

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General Information

  • CAS No. 22526-30-3
  • Cat. No. CS-0133076
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆Cl₂O₂
  • Molecular Weight 205.04
  • Synonym(s) 1-(4,5-Dichloro-2-hydroxyphenyl)ethanone
  • SMILES CC(C1=CC(Cl)=C(Cl)C=C1O)=O

Synthesis

  • Route1
    • null|null
      100246-47-7
    • ~%
    • 1-(4,5-Dichloro-2-hydroxyphenyl)ethan-1-one|CS-0133076
      22526-30-3

    References

    • Schenck et al. Angewandte Chemie, 1956 , vol. 68, p. 247
  • Route2
    • null|null
      17847-51-7
    • ~70%
    • 1-(4,5-Dichloro-2-hydroxyphenyl)ethan-1-one|CS-0133076
      22526-30-3

    References

    • Tashiro, Masashi; Tsuzuki, Hirohisa; Matsumoto, Jun-ichi; Mataka, Shuntaro; Nakayama, Kouji; et al. Journal of Chemical Research, Miniprint, 1989 , # 12 p. 2826 - 2851
  • Route3
    • null|null
      95-77-2
    • ~%
    • 1-(4,5-Dichloro-2-hydroxyphenyl)ethan-1-one|CS-0133076
      22526-30-3

    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

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

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.9016
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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