Cas no 15702-62-2 (Cuprate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen (9CI))

Cuprate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen (9CI) structure
15702-62-2 structure
Product Name:Cuprate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen (9CI)
CAS No:15702-62-2
MF:C18H12CuN2O8S2
MW:511.972483634949
CID:208122
PubChem ID:190214
Update Time:2025-04-19

Cuprate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen (9CI) Chemical and Physical Properties

Names and Identifiers

    • Cuprate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen (9CI)
    • Copper, bis(hydrogen 8-hydroxy-5-quinolinesulfonato)-
    • 15702-62-2
    • Bis(hydrogen 8-hydroxy-5-quinolinesulfonato)copper
    • Cuprate(2-), bis(8-(hydroxy-kappaO)-5-quinolinesulfonato(2-)-kappaN1)-, dihydrogen
    • Inchi: 1S/2C9H7NO4S.Cu/c2*11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7;/h2*1-5,11H,(H,12,13,14);/q;;+2/p-2
    • InChI Key: TWNFAXBNXXWFEW-UHFFFAOYSA-L
    • SMILES: [Cu+2].S(C1=CC=C(C2C1=CC=CN=2)[O-])(=O)(=O)[O-].S(C1=CC=C(C2C1=CC=CN=2)[O-])(=O)(=O)[O-].[H+].[H+]

Computed Properties

  • Exact Mass: 510.93316
  • Monoisotopic Mass: 510.933
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 0
  • Complexity: 310
  • Covalently-Bonded Unit Count: 5
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 203?2

Experimental Properties

  • PSA: 186.3
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