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CAS 1445085-92-6

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[2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][2′-[bis(1,1-dimethylethyl)phosphino-κP]-N,N-dimethyl[1,1′-biphenyl]-2-amine](methanesulfonato-κO)palladium

Description:
The chemical substance with the name "[2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][2′-[bis(1,1-dimethylethyl)phosphino-κP]-N,N-dimethyl[1,1′-biphenyl]-2-amine](methanesulfonato-κO)palladium" and CAS number "1445085-92-6" is a palladium complex that features a biphenyl backbone and various functional groups, including amino and phosphino moieties. This compound is characterized by its coordination of palladium to a ligand system that enhances its catalytic properties, particularly in cross-coupling reactions such as Suzuki or Heck reactions. The presence of bulky substituents, like bis(1,1-dimethylethyl)phosphino groups, contributes to its stability and selectivity in catalytic processes. Additionally, the methanesulfonate group may influence solubility and reactivity in different solvents. Overall, this compound exemplifies the design of organometallic complexes for applications in organic synthesis, particularly in facilitating carbon-carbon bond formation. Its unique structural features make it a valuable tool in the field of catalysis.
Formula:C35H45N2O3PPdS
InChI:InChI=1S/C22H32NP.C12H10N.CH4O3S.Pd/c1-21(2,3)24(22(4,5)6)20-16-12-10-14-18(20)17-13-9-11-15-19(17)23(7)8;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h9-16H,1-8H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1;;+2/p-1
InChI key:InChIKey=RGTUYPAURBKPFN-UHFFFAOYSA-M
SMILES:[P](C(C)(C)C)(C(C)(C)C)([Pd+2]1([O-]S(C)(=O)=O)[C-]=2C(C=3C([NH2]1)=CC=CC3)=CC=CC2)C4=C(C=CC=C4)C5=C(N(C)C)C=CC=C5
Synonyms:
  • [2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][2′-[bis(1,1-dimethylethyl)phosphino-κP]-N,N-dimethyl[1,1′-biphenyl]-2-amine](methanesulfonato-κO)palladium
  • Palladium, [2′-(amino-κN)[1,1′-biphenyl]-2-yl-κC][2′-[bis(1,1-dimethylethyl)phosphino-κP]-N,N-dimethyl[1,1′-biphenyl]-2-amine](methanesulfonato-κO)-
  • t-BuDavePhos Pd G3
  • Methanesulfonato2-Di-t-butylphosphino-2'-(N,N-dimethylamino)biphenyl)(2'-amino-1,1'-biphenyl-2-yl)palladium(II)
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