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Dihydrogen di-μ-chlorotetrakis(di-tert-butylphosphinito)dipalladate

Catalog Number
ACM386706316
Product Name
Dihydrogen di-μ-chlorotetrakis(di-tert-butylphosphinito)dipalladate
CAS
386706-31-6
  • Product Overview
  • Usage
Synonyms
Ditert-butylphosphinite;ditert-butylphosphinous acid;palladium;dihydrochloride
Molecular Weight
932.6
Molecular Formula
C32H76Cl2O4P4Pd2
Canonical SMILES
CC(C)(C)P(C(C)(C)C)O.CC(C)(C)P(C(C)(C)C)O.CC(C)(C)P(C(C)(C)C)[O-].CC(C)(C)P(C(C)(C)C)[O-].Cl.Cl.[Pd].[Pd]
InChI
InChI=1S/2C8H19OP.2C8H18OP.2ClH.2Pd/c4*1-7(2,3)10(9)8(4,5)6;/h2*9H,1-6H3;2*1-6H3;2*1H;/q;2*-1;
InChI Key
WJNABTRGRXAOEB-UHFFFAOYSA-N
Melting Point
280 °C
Purity
97%+
Appearance
Light yellow to amber to dark green powder to crystal
Complexity
187
Covalently-Bonded Unit Count
8
Defined Atom Stereocenter Count
0
Exact Mass
932.21449
Heavy Atom Count
44
Monoisotopic Mass
930.21407
Rotatable Bond Count
8
Topological Polar Surface Area
86.6 Ų
Application
Dihydrogen di-μ-chlorotetrakis(di-tert-butylphosphinito)dipalladate serves as a versatile organometallic catalyst designed to facilitate a range of chemical reactions. Its applications include the Heck-Matsuda arylation, which is pivotal for forming carbon-carbon bonds; the cyclopalladation of cyclic imides, a crucial step in synthesizing complex molecular structures; and the microwave-assisted Suzuki-Miyaura cross-coupling of 6-chloropyridazinones, an efficient method for constructing biaryl compounds. As such, this catalyst is an essential tool in advancing various organic synthesis processes.
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