Cas no 7478-00-4 (Benzenesulfonamide,N-[4-(aminosulfonyl)phenyl]-4-nitro-)

Benzenesulfonamide,N-[4-(aminosulfonyl)phenyl]-4-nitro- structure
7478-00-4 structure
Product Name:Benzenesulfonamide,N-[4-(aminosulfonyl)phenyl]-4-nitro-
CAS No:7478-00-4
MF:C12H11N3O6S2
MW:357.362240076065
CID:575161
PubChem ID:345312
Update Time:2025-04-19

Benzenesulfonamide,N-[4-(aminosulfonyl)phenyl]-4-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfonamide,N-[4-(aminosulfonyl)phenyl]-4-nitro-
    • 4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide
    • AC1L82HP
    • aromatic sulfonamide compound 27
    • CHEMBL23684
    • N-(4-nitro-benzenesulfonyl)-sulfanilic acid amide
    • N-(4-Nitro-benzolsulfonyl)-sulfanilsaeure-amid
    • NSC402851
    • STK407986
    • STOCK1S-20786
    • 7478-00-4
    • 4-nitro-N-(4-sulfamoylphenyl)benzenesulfonamide
    • NSC-402851
    • 1-N-(4-nitrobenzene)benzene-1,4-disulfonamide
    • PD129794
    • 4-Nitro-N-(4-sulfamoylphenyl)benzene-1-sulfonamide
    • DTXSID70323036
    • AKOS000601525
    • BDBM16662
    • Inchi: 1S/C12H11N3O6S2/c13-22(18,19)11-5-1-9(2-6-11)14-23(20,21)12-7-3-10(4-8-12)15(16)17/h1-8,14H,(H2,13,18,19)
    • InChI Key: AGZMQTIIZFXACL-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)[N+](=O)[O-])(NC1C=CC(=CC=1)S(N)(=O)=O)(=O)=O

Computed Properties

  • Exact Mass: 357.00903
  • Monoisotopic Mass: 357.009
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 4
  • Complexity: 615
  • 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: 1.4
  • Topological Polar Surface Area: 169?2

Experimental Properties

  • Density: 1.629
  • Boiling Point: 607.7°C at 760 mmHg
  • Flash Point: 321.3°C
  • Refractive Index: 1.674
  • PSA: 149.47
  • LogP: 4.50110

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