Cas no 1060804-39-8 (3-Fluoro-5-nitropyridine)

3-Fluoro-5-nitropyridine is a fluorinated nitropyridine derivative widely used as a versatile intermediate in organic synthesis and pharmaceutical research. Its key advantages include the presence of both electron-withdrawing nitro and fluoro substituents, which enhance reactivity in nucleophilic aromatic substitution and cross-coupling reactions. The compound's structural features make it valuable for constructing complex heterocyclic frameworks, particularly in agrochemical and medicinal chemistry applications. It exhibits good stability under standard handling conditions and offers predictable regioselectivity in further functionalization. The fluorine atom also contributes to improved metabolic stability in bioactive molecules, making this intermediate particularly useful for drug discovery and development.
3-Fluoro-5-nitropyridine structure
3-Fluoro-5-nitropyridine structure
Product Name:3-Fluoro-5-nitropyridine
CAS No:1060804-39-8
MF:C5H3FN2O2
MW:142.08792424202
MDL:MFCD13189114
CID:1038775
PubChem ID:46911836
Update Time:2025-07-10

3-Fluoro-5-nitropyridine Chemical and Physical Properties

Names and Identifiers

    • 3-Fluoro-5-nitropyridine
    • CL0299
    • 1349AA
    • AB67769
    • RP20716
    • AK100223
    • AB0050815
    • ST24022887
    • SY096725
    • AKOS015891921
    • CS-W006153
    • 1060804-39-8
    • SCHEMBL17873457
    • MFCD13189114
    • EN300-195664
    • J-512537
    • DS-3488
    • DTXSID90677245
    • DTXCID60627994
    • MDL: MFCD13189114
    • Inchi: 1S/C5H3FN2O2/c6-4-1-5(8(9)10)3-7-2-4/h1-3H
    • InChI Key: LBPCMDALPLHBTE-UHFFFAOYSA-N
    • SMILES: FC1=CN=CC(=C1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 142.01800
  • Monoisotopic Mass: 142.01785550g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 136
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 58.7
  • XLogP3: 0.8

Experimental Properties

  • PSA: 58.71000
  • LogP: 1.65210

3-Fluoro-5-nitropyridine Pricemore >>

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