chempirical

Dichloro(1,5-cyclooctadiene)palladium

C8H12Cl2PdCAS 12107-56-1285.50 g/mol

Open in Covalent MOL file
Cl−Cl−Pd2+
Alkene

Properties

Molecular formula
C8H12Cl2Pd
Molar mass
285.50 g/mol
Exact mass
283.9351 Da
Melting point
210–215 °C
logP
-3.32Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
12107-56-1
SMILES
C1=CCCC=CCC1.[Cl-].[Cl-].[Pd+2]
InChIKey
RRHPTXZOMDSKRS-UHFFFAOYSA-L
InChI
InChI=1S/C8H12.2ClH.Pd/c1-2-4-6-8-7-5-3-1;;;/h1-2,7-8H,3-6H2;2*1H;/q;;;+2/p-2

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Names and synonyms

9 names
  • Palladium, dichloro[(1,2,5,6-η)-1,5-cyclooctadiene]-
  • Palladium, dichloro(1,5-cyclooctadiene)-
  • 1,5-Cyclooctadiene, palladium complex
  • Dichloro[(1,2,5,6-η)-1,5-cyclooctadiene]palladium
  • (1,5-Cyclooctadiene)palladium dichloride
  • Dichloro(cyclooctadiene)palladium
  • Dichloro(1,5-cyclooctadiene)palladium(II)
  • Dichloro(η4-1,5-cyclooctadiene)palladium
  • NSC 169973

Work with Dichloro(1,5-cyclooctadiene)palladium

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

Dichloro(cycloocta-1,5-diene)platinum(II)12080-32-960 % similar Cyclooctadiene rhodium chloride dimer12092-47-660 % similar Cyclooctadiene iridium chloride dimer12112-67-360 % similar Dichloro[(1,2,5,6-η)-1,5-cyclooctadiene]ruthenium50982-12-260 % similar Dichloro[(1,2,5,6-η)-1,5-cyclooctadiene]ruthenium50982-13-360 % similar 1,5-Cyclooctadiene111-78-450 % similar 1,5-Cyclooctadiene1552-12-150 % similar 1,5,9-Cyclododecatriene4904-61-450 % similar

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

Elsewhere

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