Modeling the effect of ligands and solvation on hydrolysis variants in the Pd(II)-Catalyzed hydroxycarbonylation of pentenoic acids
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DOI: 10.1016/j.jorganchem.2020.121221
Abstract: Abstract We explored computationally variations in the hydrolysis step of the Pd(II)-catalyzed hydroxycarbonylation of pentenoic acids for several ligands L2 = 1,2-bis[(di-R)phosphinomethyl]benzene where R = tert-butyl, methyl, or phenyl, referring to these ligands by DTBPX, DMPX, and DPPX, respectively.… read more here.
Keywords: catalyzed hydroxycarbonylation; pentenoic acids; mechanism; hydrolysis ... See more keywords