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CS-W001157 4
Total: USD 88.00

4-(3-Nitropyridin-2-yl)benzoic acid

  • CAS No. 847446-89-3

  • Cat. No. CS-0360072
  • Purity95+%
  • MDL No.None

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

4-(3-Nitropyridin-2-yl)benzoic acid|CS-0360072

Structure of 847446-89-3

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General Information

  • CAS No. 847446-89-3
  • Cat. No. CS-0360072
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₈N₂O₄
  • Molecular Weight 244.20
  • Synonym(s) None
  • SMILES C1=CC(=C(C2=CC=C(C=C2)C(=O)O)N=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • 4-(3-Nitropyridin-2-yl)benzaldehyde|CS-0330926
      847446-87-1
    • ~%
    • 4-(3-Nitropyridin-2-yl)benzoic acid|CS-0360072
      847446-89-3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 15, # 3 p. 631 - 634
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 15, # 3 p. 631 - 634

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

Quality Control

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Computational Chemistry Data

  • TPSA   93.33
  • LogP   2.355
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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