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3-(4-Chlorophenyl)pentanedioic acid Baclofen Impurity

  • CAS No. 35271-74-0

  • Cat. No. CS-0228828
  • Purity≥98%
  • MDL No.MFCD00190249

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

3-(4-Chlorophenyl)pentanedioic acid Baclofen  Impurity|CS-0228828

Structure of 35271-74-0

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General Information

  • CAS No. 35271-74-0
  • Cat. No. CS-0228828
  • Purity ≥98%
  • MDL No. MFCD00190249
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁ClO₄
  • Molecular Weight 242.66
  • Synonym(s) β-(4-chlorophenyl)Glutaric acid
  • SMILES O=C(O)CC(C1=CC=C(Cl)C=C1)CC(O)=O

Synthesis

  • Route1

    References

    • Adamo, Mauro F.A.; Konda, Vivekananda R.; Donati, Donato; Sarti-Fantoni, Piero; Torroba, Tomas Tetrahedron, 2007 , vol. 63, # 39 p. 9741 - 9745
  • Route2
    • Baclofen Impurity 10|CS-1000155
      101104-10-3
    • ~%
    • 3-(4-Chlorophenyl)pentanedioic acid Baclofen  Impurity|CS-0228828
      35271-74-0

    References

    • Journal of Medicinal Chemistry, , vol. 44, # 12 p. 1938 - 1950
  • Route3

    References

    • US2792418 , ; Journal of the American Chemical Society, , vol. 81, p. 5733,5735

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   74.6
  • LogP   2.373
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   5

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