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CS-W001157 4
Total: USD 88.00

1-(3-Bromo-2,4-dihydroxyphenyl)ethan-1-one

  • CAS No. 60990-39-8

  • Cat. No. CS-0524939
  • Purity≥98%
  • MDL No.None

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

1-(3-Bromo-2,4-dihydroxyphenyl)ethan-1-one|CS-0524939

Structure of 60990-39-8

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General Information

  • CAS No. 60990-39-8
  • Cat. No. CS-0524939
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO₃
  • Molecular Weight 231.04
  • Synonym(s) Ethanone, 1-(3-bromo-2,4-dihydroxyphenyl)-
  • SMILES CC(C1=CC=C(O)C(Br)=C1O)=O

Synthesis

  • Route1
    • 1-(3-Bromo-2-hydroxy-4-methoxyphenyl)ethan-1-one|CS-1153908
      39503-62-3
    • ~74%
    • 1-(3-Bromo-2,4-dihydroxyphenyl)ethan-1-one|CS-0524939
      60990-39-8

    References

    • Khilevich, Albert; Liu, Bin; Mayhugh, Daniel Ray; Schkeryantz, Jeffrey Michael; Zhang, Deyi Patent: US2010/16373 A1, 2010 ; Location in patent: Page/Page column 12 ;
  • Route2

    References

    • Merck and Co., Inc. Patent: WO2004/18386 A2, 2004 ; Location in patent: Page 41 ; WO 2004/018386 A2
  • Route3

    References

    • NICHOLAS PIRAMAL INDIA LIMITED Patent: WO2005/35495 A2, 2005 ; Location in patent: Page/Page column 102-103 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   2.0629
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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