chempirical

[(1,2,5,6-η)-1,5-Cyclooctadiene](2,4-pentanedionato-κO2,κO4)rhodium

C13H19O2RhCAS 12245-39-5310.20 g/mol

Open in Covalent MOL file
OCH−ORh+
AlkeneKetone

Properties

Molecular formula
C13H19O2Rh
Molar mass
310.20 g/mol
Exact mass
310.0440 Da
logP
3.04Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
12245-39-5
SMILES
C1=CCCC=CCC1.CC(=O)[CH-]C(C)=O.[Rh+]
InChIKey
ULVMWGPNSJNVMV-UHFFFAOYSA-N
InChI
InChI=1S/C8H12.C5H7O2.Rh/c1-2-4-6-8-7-5-3-1;1-4(6)3-5(2)7;/h1-2,7-8H,3-6H2;3H,1-2H3;/q;-1;+1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

17 names · show all
  • Rhodium, [(1,2,5,6-η)-1,5-cyclooctadiene](2,4-pentanedionato-κO2,κO4)-
  • Rhodium, (1,5-cyclooctadiene)(2,4-pentanedionato)-
  • Rhodium, [(1,2,5,6-η)-1,5-cyclooctadiene](2,4-pentanedionato-O,O′)-
  • Rhodium, (2,4-pentanedionato)(1,5-cyclooctadiene)-
  • Rhodium, [(1,2,5,6-η)-1,5-cyclooctadiene](2,4-pentanedionato-κO,κO′)-
  • 1,5-Cyclooctadiene, rhodium complex
  • (1,5-Cyclooctadiene)(acetylacetonate)rhodium
  • Acetylacetonate(1,5-cyclooctadiene)rhodium
  • (Acetylacetonato)(cyclooctadiene)rhodium
  • (Acetylacetonato)(1,5-cyclooctadiene)rhodium
  • Rhodium 1,5-cyclooctadiene(2,4-pentanedionate)
  • (1,5-Cyclooctadiene)rhodium acetylacetonate
  • (1,5-Cyclooctadiene)(2,4-pentadionato)rhodium(I)
  • NSC 240030
  • Acetylacetonate(cyclooctadiene)rhodium
  • (1,5-Cyclooctadiene)(acetylacetonato)rhodium(I)
  • (Acetylacetonato)(η4-1,5-cyclooctadiene)rhodium

Work with [(1,2,5,6-η)-1,5-Cyclooctadiene](2,4-pentanedionato-κO2,κO4)rhodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bis(η2-ethene)(2,4-pentanedionato-κO,κO′)rhodium12082-47-263 % similar Dicarbonyl(acetylacetonato)rhodium(I)14874-82-956 % similar (T-4)-Bis(2,4-pentanedionato-κO2,κO4)beryllium10210-64-750 % similar Copper(II) acetylacetonate13395-16-950 % similar Vanadium(III) acetylacetonate13476-99-850 % similar Aluminium acetylacetonate13963-57-050 % similar Bis(acetylacetonato)iron(II)14024-17-050 % similar Tris(acetylacetonato)iron(III)14024-18-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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