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CS-W001157 4
Total: USD 88.00

2',4'-Difluoro-[1,1'-biphenyl]-4-carboxylic acid

  • CAS No. 331760-41-9

  • Cat. No. CS-0205015
  • Purity≥96%
  • MDL No.MFCD04117386

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

2',4'-Difluoro-[1,1'-biphenyl]-4-carboxylic acid |CS-0205015

Structure of 331760-41-9

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General Information

  • CAS No. 331760-41-9
  • Cat. No. CS-0205015
  • Purity ≥96%
  • MDL No. MFCD04117386
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈F₂O₂
  • Molecular Weight 234.20
  • Synonym(s) 4-(2,4-difluorophenyl)benzoic Acid
  • SMILES O=C(O)C=1C=CC(=CC1)C2=CC=C(F)C=C2F

Synthesis

  • Route1
    • Methyl 2',4'-difluoro-[1,1'-biphenyl]-4-carboxylate|CS-0661451
      268746-75-4
    • ~93%
    • 2',4'-Difluoro-[1,1'-biphenyl]-4-carboxylic acid |CS-0205015
      331760-41-9

    References

    • ELI LILLY AND COMPANY Patent: WO2006/66173 A2, 2006 ; Location in patent: Page/Page column 75 ; WO 2006/066173 A2
  • Route2
    • null|null
      1400592-57-5
    • ~%
    • 2',4'-Difluoro-[1,1'-biphenyl]-4-carboxylic acid |CS-0205015
      331760-41-9

    References

    • Aventis Pharma Deutschland GmbH Patent: US2004/220191 A1, 2004 ;
  • Route3

    References

    • Adamski-Werner, Sara L.; Palaninathan, Satheesh K.; Sacchettini, James C.; Kelly, Jeffery W. Journal of Medicinal Chemistry, 2004 , vol. 47, # 2 p. 355 - 374

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   37.3
  • LogP   3.33
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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