Bis(triphenylphosphine)nickel(II) bromide

C36H30Br2NiP2CAS 14126-37-5743.08 g/mol

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PPNiBrBr
Phosphine

Properties

Molecular formula
C36H30Br2NiP2
Molar mass
743.08 g/mol
Exact mass
739.9543 Da
logP
8.58Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
6

Hazards

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

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Identifiers

CAS number
14126-37-5
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.[Ni](Br)Br
InChIKey
QEKXARSPUFVXIX-UHFFFAOYSA-L
InChI
InChI=1S/2C18H15P.2BrH.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2

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Work with Bis(triphenylphosphine)nickel(II) bromide

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Triphenylphosphine603-35-0Parent compound Triphenylphosphonium bromide6399-81-1Salt

Similar compounds

1,4-Bis(diphenylphosphino)benzene1179-06-263 % similar Tetrakis(triphenylphosphine)palladium14221-01-357 % similar Tetrakis(triphenylphosphine)platinum14221-02-457 % similar Hydrotetrakis(triphenylphosphine)rhodium18284-36-157 % similar Dichlorotris(triphenylphosphine)ruthenium(II)15529-49-452 % similar Bis(triphenylphosphine)palladium chloride13965-03-250 % similar 1,2-Bis(diphenylphosphino)benzene13991-08-750 % similar Chloro(triphenylphosphine)gold(I)14243-64-250 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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