Cas no 923190-34-5 (Benzenamine, 3,3',3''-[1,3,5-benzenetriyltris(oxy)]tris[6-nitro-)

Benzenamine, 3,3',3''-[1,3,5-benzenetriyltris(oxy)]tris[6-nitro- structure
923190-34-5 structure
Product Name:Benzenamine, 3,3',3''-[1,3,5-benzenetriyltris(oxy)]tris[6-nitro-
CAS No:923190-34-5
MF:C24H18N6O9
MW:534.43452501297
CID:738101
PubChem ID:71445869
Update Time:2025-04-19

Benzenamine, 3,3',3''-[1,3,5-benzenetriyltris(oxy)]tris[6-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 3,3',3''-[1,3,5-benzenetriyltris(oxy)]tris[6-nitro-
    • 5-[3,5-bis(3-amino-4-nitrophenoxy)phenoxy]-2-nitroaniline
    • DTXSID00854383
    • 3,3',3''-[Benzene-1,3,5-triyltris(oxy)]tris(6-nitroaniline)
    • 923190-34-5
    • Inchi: 1S/C24H18N6O9/c25-19-10-13(1-4-22(19)28(31)32)37-16-7-17(38-14-2-5-23(29(33)34)20(26)11-14)9-18(8-16)39-15-3-6-24(30(35)36)21(27)12-15/h1-12H,25-27H2
    • InChI Key: RNZZAPGXHZMQBY-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=C(C=1)N)[N+](=O)[O-])C1C=C(C=C(C=1)OC1C=CC(=C(C=1)N)[N+](=O)[O-])OC1C=CC(=C(C=1)N)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 534.11352617g/mol
  • Monoisotopic Mass: 534.11352617g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 39
  • Rotatable Bond Count: 6
  • Complexity: 745
  • 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: 5.6
  • Topological Polar Surface Area: 243?2
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