Cas no 40314-84-9 (Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide)

2-chloro-6-methyl-4-nitropyridine 1-oxide is a versatile organic compound with a complex structure. It exhibits notable stability and reactivity, making it a valuable intermediate in the synthesis of various pharmaceuticals and agrochemicals. The presence of the nitro and chloro groups provides a high degree of substitution, enhancing its reactivity in chemical transformations. This compound is particularly sought after for its potential in developing novel therapeutic agents.
Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide structure
40314-84-9 structure
Product Name:Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide
CAS No:40314-84-9
MF:C6H5ClN2O3
MW:188.56850028038
MDL:MFCD01194030
CID:1512355
PubChem ID:2751813
Update Time:2025-07-15

Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide
    • 2-chloro-6-methyl-4-nitro-Pyridine,1-oxide
    • 2-chloro-6-methyl-4-nitro-1-oxidopyridin-1-ium
    • 2-Chloro-6-methyl-4-nitropyridine 1-oxide
    • 2-CHLORO-6-METHYL-4-NITROPYRIDIN-N-OXIDE
    • 6-chloro-4-nitro-2-picoline-1-oxide
    • 40314-84-9
    • ZOTROWSASXESEG-UHFFFAOYSA-N
    • MB01719
    • 2-chloro-6-methyl-4-nitropyridine N-oxide
    • SCHEMBL899185
    • 2-CHLORO-6-METHYL-4-NITROPYRIDIN-1-IUM-1-OLATE
    • DB-104501
    • AM86947
    • N10147
    • J-508965
    • 2-Chloro-6-methyl-4-nitropyridine1-oxide
    • 2-Chloro-4-nitro-6-methyl-pyridine 1-oxide
    • DTXSID20372852
    • AKOS004906912
    • MDL: MFCD01194030
    • Inchi: 1S/C6H5ClN2O3/c1-4-2-5(9(11)12)3-6(7)8(4)10/h2-3H,1H3
    • InChI Key: ZOTROWSASXESEG-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=CC(C)=[N+]1[O-])[N+](=O)[O-]

Computed Properties

  • Exact Mass: 187.99895
  • Monoisotopic Mass: 187.9988697g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 184
  • 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
  • XLogP3: 1
  • Topological Polar Surface Area: 71.3?2

Experimental Properties

  • PSA: 70.08

Pyridine, 2-chloro-6-methyl-4-nitro-, 1-oxide Pricemore >>

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