Cas no 49804-47-9 (N-(4-Methyl-2,6-dinitrophenyl)acetamide)

N-(4-Methyl-2,6-dinitrophenyl)acetamide is a nitrophenyl derivative with applications in organic synthesis and chemical research. Its structure, featuring both nitro and acetamide functional groups, makes it a versatile intermediate for the preparation of more complex compounds. The compound exhibits stability under standard conditions, facilitating handling and storage. Its well-defined reactivity profile allows for selective transformations, particularly in electrophilic aromatic substitution and reduction reactions. The presence of electron-withdrawing nitro groups enhances its utility in synthetic pathways requiring controlled reactivity. This compound is commonly employed in the development of dyes, pharmaceuticals, and agrochemicals, where precise functionalization is critical.
N-(4-Methyl-2,6-dinitrophenyl)acetamide structure
49804-47-9 structure
Product Name:N-(4-Methyl-2,6-dinitrophenyl)acetamide
CAS No:49804-47-9
MF:C9H9N3O5
MW:239.184861898422
CID:324536
PubChem ID:3796458
Update Time:2025-06-06

N-(4-Methyl-2,6-dinitrophenyl)acetamide Chemical and Physical Properties

Names and Identifiers

    • N-(4-Methyl-2,6-dinitrophenyl)acetamide
    • 2,6-Dinitro-4-methylacetanilide
    • 3,5-dinitro-4(N-acetyl)aminotoluene
    • 3.5-Dinitro-4-acetamino-toluol
    • 4,6-Dimethyl-2-nitro-acetanilid
    • 4'-Methyl-2',6'-dinitroacetanilid
    • AC1MXUUV
    • acetic acid-(4-methyl-2,6-dinitro-anilide)
    • AE-562
    • Essigsaeure-(4-methyl-2,6-dinitro-anilid)
    • Oprea1_415161
    • SBB058490
    • 49804-47-9
    • N-{2,6-bisnitro-4-methylphenyl}acetamide
    • AKOS015841066
    • FT-0765963
    • AE-562/12222480
    • ACETAMIDE,N-(4-METHYL-2,6-DINITROPHENYL)-
    • DTXSID80396539
    • LABOTEST-BB LT01290080
    • CS-0190378
    • Inchi： 1S/C9H9N3O5/c1-5-3-7(11(14)15)9(10-6(2)13)8(4-5)12(16)17/h3-4H,1-2H3,(H,10,13)
    • InChI Key： OFIDOLGSIHMBKD-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1C=C(C)C=C(C=1NC(C)=O)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 239.05427
  • Monoisotopic Mass: 239.054
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 311
  • 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: 0.9
  • Topological Polar Surface Area: 121?2

Experimental Properties

  • Density: 1.472
  • Boiling Point: 448.6°C at 760 mmHg
  • Flash Point: 225.1°C
  • Refractive Index: 1.638
  • PSA: 115.38

N-(4-Methyl-2,6-dinitrophenyl)acetamide Pricemore >>

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