Cas no 505065-16-7 (Acetic acid, 2,2'-[(2,5-diiodo-1,4-phenylene)bis(oxy)]bis-)

Acetic acid, 2,2'-[(2,5-diiodo-1,4-phenylene)bis(oxy)]bis- structure
505065-16-7 structure
Product Name:Acetic acid, 2,2'-[(2,5-diiodo-1,4-phenylene)bis(oxy)]bis-
CAS No:505065-16-7
MF:C10H8I2O6
MW:477.975868225098
CID:364777
PubChem ID:67960309
Update Time:2025-04-19

Acetic acid, 2,2'-[(2,5-diiodo-1,4-phenylene)bis(oxy)]bis- Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, 2,2'-[(2,5-diiodo-1,4-phenylene)bis(oxy)]bis-
    • 2-[4-(carboxymethoxy)-2,5-diiodophenoxy]acetic acid
    • DTXSID70737851
    • 505065-16-7
    • 2,2'-[(2,5-Diiodo-1,4-phenylene)bis(oxy)]diacetic acid
    • SCHEMBL9905095
    • Inchi: 1S/C10H8I2O6/c11-5-1-7(17-3-9(13)14)6(12)2-8(5)18-4-10(15)16/h1-2H,3-4H2,(H,13,14)(H,15,16)
    • InChI Key: ROXGCRKGHUDAJX-UHFFFAOYSA-N
    • SMILES: IC1C=C(C(=CC=1OCC(=O)O)I)OCC(=O)O

Computed Properties

  • Exact Mass: 477.84004
  • Monoisotopic Mass: 477.84103g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 6
  • Complexity: 281
  • 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: 2.4
  • Topological Polar Surface Area: 93.1?2

Experimental Properties

  • PSA: 93.06
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