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CS-W001157 4
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Perfluorophenyl isonicotinate

  • CAS No. 360574-34-1

  • Cat. No. CS-0129187
  • Purity≥98%
  • MDL No.MFCD02916455

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

Perfluorophenyl isonicotinate|CS-0129187

Structure of 360574-34-1

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General Information

  • CAS No. 360574-34-1
  • Cat. No. CS-0129187
  • Purity ≥98%
  • MDL No. MFCD02916455
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₄F₅NO₂
  • Molecular Weight 289.16
  • Synonym(s) Pentafluorophenyl pyridine-4-carboxylate
  • SMILES O=C(C1=CC=NC=C1)OC2=C(F)C(F)=C(F)C(F)=C2F

Synthesis

  • Route1

    References

    • Babadzhanova; Kirij; Yagupolskii; Tyrra; Naumann Tetrahedron, 2005 , vol. 61, # 7 p. 1813 - 1819
  • Route2

    References

    • Christensen, Jorn B. Molecules, 2001 , vol. 6, # 1 p. 47 - 51
  • Route3
    • Isonicotinic acid Nicotinic Acid  Impurity|CS-0229405
      55-22-1
    • ~%
    • Perfluorophenyl isonicotinate|CS-0129187
      360574-34-1

    References

    • Christensen, Jorn B. Molecules, 2001 , vol. 6, # 1 p. 47 - 51

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.9963
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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