trans-Dibromobis(triphenylphosphine)palladium(II)
Product Information
Molecular Formula
[(C6H5)3P]2PdBr2
Molecular Weight
790.80
Description
Catalyst for:• Equilibrium palladation of alkanes and arenes and functionalization of hydrocarbonsReactant for:• Homocoupling reactions induced by P-C reductive elimination• Preparation of palladium imidazolylidene complexes via Suzuki coupling reactions
Synonyms
trans-Dibromobis(triphenylphosphine)palladium(II); dibromopalladium; triphenylphosphane; trans-Dibromobis(triphenylphosphine)palladium(II), Pd 13.4%; trans-dibromobis(triphenylphosphine)-palladium(ii; trans-Dibromobis(triphenylphosphine)palladium( cento); trans-Dibromobis(triphenylphosphine)palladium(II), 95%
IUPAC Name
dibromopalladiumtriphenylphosphane
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.Br[Pd]Br
InChI
InChI=1S/2C18H15P.2BrH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h2*1-15H2*1H/q+2/p-2
InChI Key
MCSDDEAMPOYJJI-UHFFFAOYSA-L
Flash Point
Not applicable
Purity
95%
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
6
Exact Mass
789.92038 g/mol
Monoisotopic Mass
787.92243 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
41
Formal Charge
0
Complexity
204
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
3
Compound Is Canonicalized
Yes
