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CS-W001157 4
Total: USD 88.00

6-(4-Fluorophenyl)nicotinic acid

  • CAS No. 223127-24-0

  • Cat. No. CS-0187171
  • Molecule weight217.20
  • Purity≥95%
  • MDL No.None

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

6-(4-Fluorophenyl)nicotinic acid|CS-0187171

Structure of 223127-24-0

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General Information

  • CAS No. 223127-24-0
  • Cat. No. CS-0187171
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₈FNO₂
  • Molecular Weight 217.20
  • Synonym(s) 6-(4-fluorophenyl)-pyridine-3-carboxylic acid
  • SMILES C1=C(C=CC(=C1)F)C2=NC=C(C=C2)C(=O)O

Synthesis

  • Route1
    • Methyl 6-(4-fluorophenyl)nicotinate|CS-0750100
      149500-84-5
    • ~35%
    • 6-(4-Fluorophenyl)nicotinic acid|CS-0187171
      223127-24-0

    References

    • ELI LILLY AND COMPANY Patent: WO2004/94382 A1, 2004 ; Location in patent: Page 21 ; WO 2004/094382 A1
  • Route2

    References

    • BANYU PHARMACEUTICAL CO., LTD. Patent: EP1657242 A1, 2006 ; Location in patent: Page/Page column 31 ;

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.19
  • LogP   2.5859
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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