Cas no 55973-81-4 (Benzenamine, 4-[2-(2-methoxyethoxy)ethoxy]-2-nitro-)

Benzenamine, 4-[2-(2-methoxyethoxy)ethoxy]-2-nitro- structure
55973-81-4 structure
Product Name:Benzenamine, 4-[2-(2-methoxyethoxy)ethoxy]-2-nitro-
CAS No:55973-81-4
MF:C11H16N2O5
MW:256.255143165588
CID:350187
PubChem ID:71444915
Update Time:2025-04-19

Benzenamine, 4-[2-(2-methoxyethoxy)ethoxy]-2-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 4-[2-(2-methoxyethoxy)ethoxy]-2-nitro-
    • 4-[2-(2-methoxyethoxy)ethoxy]-2-nitroaniline
    • 55973-81-4
    • DTXSID90853663
    • Inchi: 1S/C11H16N2O5/c1-16-4-5-17-6-7-18-9-2-3-10(12)11(8-9)13(14)15/h2-3,8H,4-7,12H2,1H3
    • InChI Key: JJPQLGZBXIOOSX-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=C(C=1)[N+](=O)[O-])N)CCOCCOC

Computed Properties

  • Exact Mass: 256.10598
  • Monoisotopic Mass: 256.10592162g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 7
  • Complexity: 246
  • 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: 1.6
  • Topological Polar Surface Area: 99.5?2

Experimental Properties

  • PSA: 96.85
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