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CS-W001157 4
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2-Acetyl-3,5-dibromo-2-hydroxy-2lambda5-benzoic acid

  • CAS No. 54223-76-6

  • Cat. No. CS-0580747
  • Molecule weight338.96
  • Purity≥98%
  • MDL No.None

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

2-Acetyl-3,5-dibromo-2-hydroxy-2lambda5-benzoic acid|CS-0580747

Structure of 54223-76-6

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General Information

  • CAS No. 54223-76-6
  • Cat. No. CS-0580747
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇Br₂O₄
  • Molecular Weight 338.96
  • Synonym(s) 2-acetyl-3,5-dibromosalicylic acid
  • SMILES OC1(C(C)=O)=C(Br)C=C(Br)C=C1C(O)=O

Synthesis

  • Route1

    References

    • Kurono; Yamada; Hata; Okada; Takeuchi; Ikeda Chemical and Pharmaceutical Bulletin, 1984 , vol. 32, # 9 p. 3715 - 3719
  • Route2
    • Salicylic acid, ≥99%|CS-1268363
      69-72-7
    • ~%
    • 2-Acetyl-3,5-dibromo-2-hydroxy-2lambda5-benzoic acid|CS-0580747
      54223-76-6

    References

    • Robertson Journal of the Chemical Society, 1902 , vol. 81, p. 1480
  • Route3

    References

    • Robertson Journal of the Chemical Society, 1902 , vol. 81, p. 1480

Safety Information

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GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H315-H319-H330-H335-H350
Precautionary Statements : P260-P261-P264-P270-P271-P280-P284-P302+P352-P304+P340-P305+P351+P338-P330-P361+P364-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   2.8351
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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