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Bis(dibenzylideneacetone)palladium(0)

Catalog Number
ACM32005360-3
Product Name
Bis(dibenzylideneacetone)palladium(0)
Structure
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CAS
32005-36-0
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Synonyms
CB-706; MFCD00051942; Bis(dibenzylideneacetone)palladium(0); (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one,palladium; GC10019; RW2139; bis(dibenzylidene-acetone)palladium; bis (dibenzylideneacetone)palladium; PubChem14428; J-400823;
IUPAC Name
(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium;
Molecular Weight
575.016g/mol
Molecular Formula
C34H28O2Pd;
Canonical SMILES
C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.[Pd];
InChI
InChI=1S/2C17H14O.Pd/c2*18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16;/h2*1-14H;/b2*13-11+,14-12+;;
InChI Key
UKSZBOKPHAQOMP-SVLSSHOZSA-N;
Complexity
272
Covalently-Bonded Unit Count
3
Defined Bond Stereocenter Count
4
EC Number
608-691-6
Exact Mass
574.112g/mol
H-Bond Acceptor
2
Heavy Atom Count
37
Monoisotopic Mass
574.112g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
34.1A^2
Application
Bis(dibenzylideneacetone)palladium(0) serves primarily as a source of soluble Pd(0), making it an essential catalyst in numerous coupling reactions. It is widely utilized in processes such as the Negishi coupling, Suzuki coupling, Carroll rearrangement, and Trost asymmetric allylic alkylation. Additionally, it plays a crucial role in facilitating Buchwald-Hartwig amination, demonstrating its versatility and importance in synthetic chemistry.
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