Cas no 15628-85-0 (Zinc,bis(L-asparaginato-kN2,kO1)-, (T-4)-)

Zinc,bis(L-asparaginato-kN2,kO1)-, (T-4)- structure
15628-85-0 structure
Product Name:Zinc,bis(L-asparaginato-kN2,kO1)-, (T-4)-
CAS No:15628-85-0
MF:C8H14N4O6Zn
MW:327.62895822525
CID:193337
PubChem ID:426303
Update Time:2025-04-19

Zinc,bis(L-asparaginato-kN2,kO1)-, (T-4)- Chemical and Physical Properties

Names and Identifiers

    • Zinc,bis(L-asparaginato-kN2,kO1)-, (T-4)-
    • zinc,(3-amino-1-carboxy-3-oxopropyl)azanide
    • NSC186328
    • NSC-186328
    • 15628-85-0
    • Inchi: 1S/2C4H7N2O3.Zn/c2*5-2(4(8)9)1-3(6)7;/h2*2,5H,1H2,(H2,6,7)(H,8,9);/q2*-1;+2
    • InChI Key: VPLDMWAXSYPRBR-UHFFFAOYSA-N
    • SMILES: [Zn+2].OC(C(CC(N)=O)[NH-])=O.OC(C(CC(N)=O)[NH-])=O

Computed Properties

  • Exact Mass: 326.02052
  • Monoisotopic Mass: 326.020476g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 305
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 163?2

Experimental Properties

  • PSA: 208.38
  • LogP: -1.36070
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