Cas no 1821-27-8 (Bis-(4-nitrophenyl)amine)

Bis-(4-nitrophenyl)amine structure
Bis-(4-nitrophenyl)amine structure
Product Name:Bis-(4-nitrophenyl)amine
CAS No:1821-27-8
MF:C12H9N3O4
MW:259.217562437058
MDL:MFCD00437044
CID:179830
PubChem ID:87560065
Update Time:2025-04-19

Bis-(4-nitrophenyl)amine Chemical and Physical Properties

Names and Identifiers

    • Bis(4-nitrophenyl)amine
    • Bis-(4-nitrophenyl)amine
    • 4-nitro-N-(4-nitrophenyl)aniline
    • Benzenamine,4-nitro-N-(4-nitrophenyl)-
    • 4,4'-Dinitrodiphenylamine
    • 4-nitro-4'-nitrodiphenylamine
    • Bis(p-nitrophenyl)amine
    • BENZENAMINE, 4-NITRO-N-(4-NITROPHENYL)-
    • Diphenylamine, 4,4'-dinitro-
    • NSC36659
    • MTWHRQTUBOTQTE-UHFFFAOYSA-N
    • STK258732
    • 4-Nitro-N-(4-nitrophenyl)aniline #
    • 4-Nitro-N-(4-nitrophenyl)benzenamine
    • NSC 36659
    • AS-64056
    • FT-0663351
    • A880928
    • EINECS 217-343-9
    • F16655
    • NSC-36659
    • AKOS000286144
    • SR-01000106615
    • SR-01000106615-1
    • B2960
    • SCHEMBL395942
    • MFCD00437044
    • 1821-27-8
    • CS-W014603
    • NS00025991
    • DTXSID20171246
    • Bis-(4-nitro-phenyl)-amine
    • 4,4''-Dinitrodiphenylamine
    • aniline, 4-nitro-N-(4-nitro)phenyl-
    • MDL: MFCD00437044
    • Inchi: 1S/C12H9N3O4/c16-14(17)11-5-1-9(2-6-11)13-10-3-7-12(8-4-10)15(18)19/h1-8,13H
    • InChI Key: MTWHRQTUBOTQTE-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1C=CC(=CC=1)NC1C=CC(=CC=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 259.05900
  • Monoisotopic Mass: 259.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 291
  • 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: 3.6
  • Topological Polar Surface Area: 104
  • Surface Charge: 0
  • Tautomer Count: nothing

Experimental Properties

  • Color/Form: Yellow crystals.
  • Density: 1.3450 (rough estimate)
  • Melting Point: 215.0 to 220.0 deg-C
  • Boiling Point: 402.47°C (rough estimate)
  • Flash Point: 234.4±24.6 °C
  • Refractive Index: 1.5700 (estimate)
  • PSA: 103.67000
  • LogP: 4.36600
  • Solubility: Not determined
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

Bis-(4-nitrophenyl)amine Security Information

Bis-(4-nitrophenyl)amine Customs Data

  • HS CODE:2921499090
  • Customs Data:

    China Customs Code:

    2921499090

    Overview:

    2921499090 Other aromatic monoamines and derivatives and their salts. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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