Cas no 33288-81-2 (Benzamide, N,N'-1,2-ethanediylbis[4-nitro-)

Benzamide, N,N'-1,2-ethanediylbis[4-nitro- structure
33288-81-2 structure
Product Name:Benzamide, N,N'-1,2-ethanediylbis[4-nitro-
CAS No:33288-81-2
MF:C16H14N4O6
MW:358.30556344986
CID:1456338
PubChem ID:2134211
Update Time:2025-04-20

Benzamide, N,N'-1,2-ethanediylbis[4-nitro- Chemical and Physical Properties

Names and Identifiers

    • N,N'-di(p-nitrobenzoyl)ethylenediamine
    • C16H14N4O6
    • 33288-81-2
    • N,N'-bis(p-nitrobenzoyl)ethylenediamine
    • KGDGPIKXAQPEMP-UHFFFAOYSA-N
    • STK399003
    • SCHEMBL11621538
    • N,N'-ethane-1,2-diylbis(4-nitrobenzamide)
    • EU-0069077
    • CHEMBL4543507
    • N,Na(2)-1,2-Ethanediylbis[4-nitrobenzamide]
    • 4-nitro-N-[2-[(4-nitrobenzoyl)amino]ethyl]benzamide
    • 4-NITRO-N-{2-[(4-NITROPHENYL)FORMAMIDO]ETHYL}BENZAMIDE
    • N,N'-1,2-ethanediylbis(4-nitrobenzamide)
    • CBDivE_011724
    • DTXSID201276787
    • AKOS001607417
    • Benzamide, N,N'-1,2-ethanediylbis[4-nitro-
    • Inchi: 1S/C16H14N4O6/c21-15(11-1-5-13(6-2-11)19(23)24)17-9-10-18-16(22)12-3-7-14(8-4-12)20(25)26/h1-8H,9-10H2,(H,17,21)(H,18,22)
    • InChI Key: KGDGPIKXAQPEMP-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC(=CC=1)[N+](=O)[O-])NCCNC(C1C=CC(=CC=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 358.09142
  • Monoisotopic Mass: 358.09133418g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 5
  • Complexity: 480
  • 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: 1.8
  • Topological Polar Surface Area: 150?2

Experimental Properties

  • PSA: 144.48
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