Cas no 320-35-4 (2,4-dinitro-5-(trifluoromethyl)aniline)

2,4-dinitro-5-(trifluoromethyl)aniline structure
320-35-4 structure
Product Name:2,4-dinitro-5-(trifluoromethyl)aniline
CAS No:320-35-4
MF:C7H4F3N3O4
MW:251.119571685791
CID:1449755
PubChem ID:156595054
Update Time:2025-04-20

2,4-dinitro-5-(trifluoromethyl)aniline Chemical and Physical Properties

Names and Identifiers

    • 2,4-dinitro-5-(trifluoromethyl)aniline
    • benzenamine, 2,4-dinitro-5-(trifluoromethyl)-
    • LogP
    • 320-35-4
    • 2,4-Dinitro-5-(trifluoromethyl)benzenamine
    • DTXSID201266279
    • Inchi: 1S/C7H4F3N3O4/c8-7(9,10)3-1-4(11)6(13(16)17)2-5(3)12(14)15/h1-2H,11H2
    • InChI Key: ZORKKNDBEYFMHB-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C(=CC=1[N+](=O)[O-])[N+](=O)[O-])N)(F)F

Computed Properties

  • Exact Mass: 251.01542
  • Monoisotopic Mass: 251.01539010g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 0
  • Complexity: 324
  • 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: 2.3
  • Topological Polar Surface Area: 118?2

Experimental Properties

  • Density: 1.686
  • Boiling Point: 399.4°C at 760 mmHg
  • Flash Point: 195.4°C
  • Refractive Index: 1.565
  • PSA: 112.3
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