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5-Chloro-α-oxo-2-thiopheneacetic acid

  • CAS No. 56479-07-3

  • Cat. No. CS-0236985
  • Molecule weight190.60
  • Purity≥97%
  • MDL No.None

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

5-Chloro-α-oxo-2-thiopheneacetic acid|CS-0236985

Structure of 56479-07-3

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General Information

  • CAS No. 56479-07-3
  • Cat. No. CS-0236985
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃ClO₃S
  • Molecular Weight 190.60
  • Synonym(s) 2-(5-Chlorothiophen-2-yl)-2-oxoacetic acid
  • SMILES O=C(O)C(C1=CC=C(Cl)S1)=O

Synthesis

  • Route1
    • Ethyl 2-(5-chlorothiophen-2-yl)-2-oxoacetate|CS-0581549
      34036-28-7
    • ~68%
    • 5-Chloro-α-oxo-2-thiopheneacetic acid|CS-0236985
      56479-07-3

    References

    • Unterhalt; Gores Archiv der Pharmazie, 1989 , vol. 322, # 11 p. 839 - 840

Safety Information

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

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   1.6688
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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