Cas no 182224-71-1 (N4-Benzyl-2,6-dichloroisonicotinamide)

N4-Benzyl-2,6-dichloroisonicotinamide is a halogenated pyridine derivative with potential applications in pharmaceutical and agrochemical research. Its structure features a benzyl-substituted amide group at the N4 position and chlorine substituents at the 2- and 6-positions of the pyridine ring, enhancing its reactivity and utility as a synthetic intermediate. The dichloro substitution pattern contributes to its stability and selectivity in cross-coupling reactions, while the benzyl group offers versatility for further functionalization. This compound is particularly valuable in the development of bioactive molecules, serving as a key precursor in medicinal chemistry for the synthesis of heterocyclic compounds with tailored properties.
N4-Benzyl-2,6-dichloroisonicotinamide structure
182224-71-1 structure
Product Name:N4-Benzyl-2,6-dichloroisonicotinamide
CAS No:182224-71-1
MF:C13H10Cl2N2O
MW:281.13730096817
CID:113808
PubChem ID:2782044
Update Time:2025-05-28

N4-Benzyl-2,6-dichloroisonicotinamide Chemical and Physical Properties

Names and Identifiers

    • N4-Benzyl-2,6-dichloroisonicotinamide
    • 4-Pyridinecarboxamide,2,6-dichloro-N-(phenylmethyl)-
    • N-benzyl-2,6-dichloropyridine-4-carboxamide
    • N-Benzyl-2,6-dichloroisonicotinamide
    • ZB007917
    • AB0022978
    • ST24031361
    • W3954
    • 2,6-dichloro-n-(phenylmethyl)-4-pyridinecarboxamide
    • 4-Pyrid
    • 4-Pyridinecarboxamide, 2,6-dichloro-N-(phenylmethyl)-
    • 182224-71-1
    • DS-0772
    • SCHEMBL8975296
    • CS-0151391
    • MFCD00125184
    • DTXSID50381912
    • A880917
    • FT-0650521
    • AKOS008916491
    • N-Benzyl-2 pound not6-dichloroisonicotinamide
    • DB-015810
    • MDL: MFCD00125184
    • Inchi: 1S/C13H10Cl2N2O/c14-11-6-10(7-12(15)17-11)13(18)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,16,18)
    • InChI Key: FMICAMHYUFNJME-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=C(N=1)Cl)C(NCC1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 280.01700
  • Monoisotopic Mass: 280.0170183g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 272
  • 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: 42
  • XLogP3: 3.5

Experimental Properties

  • Density: 1.354
  • Boiling Point: 438.3°C at 760 mmHg
  • Flash Point: 218.9°C
  • Refractive Index: 1.612
  • PSA: 41.99000
  • LogP: 3.70930

N4-Benzyl-2,6-dichloroisonicotinamide Pricemore >>

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