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Copper (II) isobutyrate

CAT: 0127-IN12990-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-IN12990-01Size:1 g
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CAS Number
15432-56-1
MDL Number
MFCD00058695
Purity
98%
Smiles
CC(C)C([O-])=O.CC(C)C([O-])=O.[Cu+2]

Chemical Information

Copper(II) isobutyrate
CAS Number15432-56-1
PubChem CID42612621
IUPAC Namecopper bis(2-methylpropanoate)
Molecular FormulaC8H14CuO4
Molecular Weight237.74
Topological Polar Surface Area80.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity51
SMILES
CC(C)C(=O)[O-].CC(C)C(=O)[O-].[Cu+2]
InChI
InChI=1S/2C4H8O2.Cu/c2*1-3(2)4(5)6;/h2*3H,1-2H3,(H,5,6);/q;;+2/p-2
InChIKey
KOKFUFYHQQCNNJ-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Copper(II) isobutyrate
CAS: 15432-56-1
CID: 42612621
Formula: C8H14CuO4
MW: 237.74
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight237.74
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass237.018806
Monoisotopic Mass237.018806
Topological Polar Surface Area80.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity51.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes
Copper (II) isobutyrate | 0127-IN12990-01 | Gentaur