chempirical

Chlorotris(triphenylphosphine)cobalt(I)

C54H45ClCoP3−CAS 26305-75-9881.26 g/mol

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Salt ratio not recorded. The source lists this compound as the parent acid and the metal without saying how many of each, so the formula and molar mass are for one of each. Check the formula on the supplier's label before you weigh it.
PPPCl−Co
Phosphine

Properties

Molecular formula
C54H45ClCoP3−
Molar mass
881.26 g/mol
Exact mass
880.1755 Da
logP
7.34Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
9

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
26305-75-9
SMILES
C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Co]
InChIKey
LNEYYSPXDKDADL-UHFFFAOYSA-M
InChI
InChI=1S/3C18H15P.ClH.Co/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h3*1-15H;1H;/p-1

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Work with Chlorotris(triphenylphosphine)cobalt(I)

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

Dichlorotris(triphenylphosphine)ruthenium(II)15529-49-475 % similar Bis(triphenylphosphine)palladium chloride13965-03-271 % similar Chloro(triphenylphosphine)gold(I)14243-64-271 % similar Bis(triphenylphosphine)nickel dichloride14264-16-571 % similar Wilkinson's catalyst14694-95-271 % similar cis-Bis(triphenylphosphine)platinum(II) chloride15604-36-171 % similar Chlorotris(triphenylphosphine)rhodium(I)16592-65-771 % similar Triphenylphosphine603-35-067 % similar

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

Elsewhere

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