Cas no 85118-11-2 ((2-ethylhexanoato-O)(isooctanoato-O)copper)

(2-ethylhexanoato-O)(isooctanoato-O)copper structure
85118-11-2 structure
Product Name:(2-ethylhexanoato-O)(isooctanoato-O)copper
CAS No:85118-11-2
MF:C16H32CuO4
MW:351.968887329102
CID:730274
PubChem ID:119057800
Update Time:2024-03-01

(2-ethylhexanoato-O)(isooctanoato-O)copper Chemical and Physical Properties

Names and Identifiers

    • Copper,(2-ethylhexanoato-kO)(isooctanoato-kO)- (9CI)
    • (2-Ethylhexanoato-O)(isooctanoato-O)copper
    • CID 119057800
    • Einecs 285-664-1
    • (2-ethylhexanoato-O)(isooctanoato-O)copper
    • Inchi: 1S/2C8H16O2.Cu/c1-7(2)5-3-4-6-8(9)10;1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);
    • InChI Key: CNMFRCSPPXIXSK-UHFFFAOYSA-N
    • SMILES: [Cu].OC(C(CC)CCCC)=O.OC(CCCCC(C)C)=O

Computed Properties

  • Exact Mass: 351.159657g/mol
  • Monoisotopic Mass: 351.159657g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 10
  • Complexity: 255
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 74.6
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