Cas no 93981-36-3 (neo-Nonadecanoic acid,iron(2+) salt (9CI))

neo-Nonadecanoic acid,iron(2+) salt (9CI) structure
93981-36-3 structure
Product Name:neo-Nonadecanoic acid,iron(2+) salt (9CI)
CAS No:93981-36-3
MF:C18H34FeO4
MW:370.305167675018
CID:805570
PubChem ID:56841398
Update Time:2025-04-19

neo-Nonadecanoic acid,iron(2+) salt (9CI) Chemical and Physical Properties

Names and Identifiers

    • neo-Nonadecanoic acid,iron(2+) salt (9CI)
    • 6,6-dimethylheptanoate,iron(2+)
    • iron bis(neonanoate)
    • DTXSID40240084
    • EINECS 301-120-9
    • 93981-36-3
    • Inchi: 1S/2C9H18O2.Fe/c2*1-9(2,3)7-5-4-6-8(10)11;/h2*4-7H2,1-3H3,(H,10,11);/q;;+2/p-2
    • InChI Key: LHEBIZLQMZIPFB-UHFFFAOYSA-L
    • SMILES: [Fe+2].[O-]C(CCCCC(C)(C)C)=O.[O-]C(CCCCC(C)(C)C)=O

Computed Properties

  • Exact Mass: 370.180645g/mol
  • Monoisotopic Mass: 370.180645g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 8
  • Complexity: 117
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 80.3?2
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