Cas no 13001-15-5 (9-Octadecenoic acid(9Z)-, nickel(2+) salt (2:1))

9-Octadecenoic acid(9Z)-, nickel(2+) salt (2:1) structure
13001-15-5 structure
Product Name:9-Octadecenoic acid(9Z)-, nickel(2+) salt (2:1)
CAS No:13001-15-5
MF:C36H66NiO4
MW:621.600253582001
CID:199799
PubChem ID:44146226
Update Time:2025-04-19

9-Octadecenoic acid(9Z)-, nickel(2+) salt (2:1) Chemical and Physical Properties

Names and Identifiers

    • 9-Octadecenoic acid(9Z)-, nickel(2+) salt (2:1)
    • (Z)-9-Octadecenoic acid, nickel(2+) salt
    • nickel(2+) oleate
    • 9-Octadecenoic acid, (Z)-, nickel(2+) salt
    • AI3-26143
    • nickelous (Z)-octadec-9-enoate
    • Dioleic acid nickel(II) salt
    • SCHEMBL201831
    • NS00085873
    • nickel oleate
    • Q18002891
    • (9Z)-9-Octadecenoic acid nickel(2+) salt (2:1)
    • nickel(II) oleate
    • nickel (II) oleate
    • 13001-15-5
    • DTXSID001047895
    • LVBIMKHYBUACBU-CVBJKYQLSA-L
    • EINECS 235-832-5
    • Inchi: 1S/2C18H34O2.Ni/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*9-10H,2-8,11-17H2,1H3,(H,19,20);/q;;+2/p-2/b2*10-9-;
    • InChI Key: LVBIMKHYBUACBU-CVBJKYQLSA-L
    • SMILES: [Ni+2].[O-]C(CCCCCCC/C=C\CCCCCCCC)=O.[O-]C(CCCCCCC/C=C\CCCCCCCC)=O

Computed Properties

  • Exact Mass: 620.43168
  • Monoisotopic Mass: 620.431452g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 28
  • Complexity: 228
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 80.3?2

Experimental Properties

  • PSA: 80.26

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