Cas no 920504-11-6 (Benzene, 1,2-diiodo-4-(1-methylethoxy)-5-nitro-)

Benzene, 1,2-diiodo-4-(1-methylethoxy)-5-nitro- structure
920504-11-6 structure
Product Name:Benzene, 1,2-diiodo-4-(1-methylethoxy)-5-nitro-
CAS No:920504-11-6
MF:C9H9I2NO3
MW:432.981607198715
CID:756691
PubChem ID:71424120
Update Time:2025-04-19

Benzene, 1,2-diiodo-4-(1-methylethoxy)-5-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,2-diiodo-4-(1-methylethoxy)-5-nitro-
    • 1,2-diiodo-4-nitro-5-propan-2-yloxybenzene
    • 920504-11-6
    • 1,2-Diiodo-4-nitro-5-[(propan-2-yl)oxy]benzene
    • DTXSID60842923
    • Inchi: 1S/C9H9I2NO3/c1-5(2)15-9-4-7(11)6(10)3-8(9)12(13)14/h3-5H,1-2H3
    • InChI Key: RMLJYWSHORCAGF-UHFFFAOYSA-N
    • SMILES: IC1C(=CC(=C(C=1)OC(C)C)[N+](=O)[O-])I

Computed Properties

  • Exact Mass: 432.86719g/mol
  • Monoisotopic Mass: 432.86719g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 232
  • 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: 3.8
  • Topological Polar Surface Area: 55?2
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