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Rhodium (II) hexanoate, dimer

CAT: 0127-IN12962-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-IN12962-01Size:50 mg
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CAS Number
62728-89-6
MDL Number
MFCD00064723
Purity
98%
Smiles
C(C1=O[Rh+2]234O=C([O-][Rh+2]2(O=C([O-]3)CCCCC)(O=C([O-]4)CCCCC)[O-]1)CCCCC)CCCC

Chemical Information

Tetrakis(hexanoate);bis(rhodium(2+))

See also: Rhodium(II) hexanoate, dimer (preferred).

CAS Number62728-89-6
PubChem CID24845992
IUPAC Nametetrakis(hexanoate);bis(rhodium(2+))
Molecular FormulaC24H44O8Rh2
Molecular Weight666.4
Topological Polar Surface Area161
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count16
Heavy Atom Count34
Formal Charge0
Complexity345
SMILES
CCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCCC(=O)[O-].[Rh+2].[Rh+2]
InChI
InChI=1S/4C6H12O2.2Rh/c4*1-2-3-4-5-6(7)8;;/h4*2-5H2,1H3,(H,7,8);;/q;;;;2*+2/p-4
InChIKey
FNSGZOCUBHMUMB-UHFFFAOYSA-J
Chemical Structure
2D Structure
2D structure of Tetrakis(hexanoate);bis(rhodium(2+))
CAS: 62728-89-6
CID: 24845992
Formula: C24H44O8Rh2
MW: 666.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight666.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count16
Exact Mass666.11461
Monoisotopic Mass666.11461
Topological Polar Surface Area161 Ų
Heavy Atom Count34
Formal Charge0
Complexity345
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count6
Compound Is CanonicalizedYes