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Tris(dibenzylideneacetone)dipalladium(0)

Catalog Number ACM51364513-2
CAS 51364-51-3
Structure {[CurrentData.Name]}
IUPAC Name (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium
Synonyms Bis[tris(dibenzylideneacetone)palladium(0)]
Molecular Weight 915.73
Molecular Formula C51H42O3Pd2
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.C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2.[Pd].[Pd]
InChI InChI=1S/3C17H14O.2Pd/c3*18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16;/h3*1-14H;/b3*13-11+,14-12+;
InChI Key CYPYTURSJDMMMP-WVCUSYJESA-N
Melting Point 152-155 °C
Purity 98%
Appearance Purple black crystalline powder
Application Amination→Buchwald-Hartwig Aminaton; Carbonylation; Cross Coupling Reactions with Arenes→Mizoroki Heck Coupling Reaction; Cross Coupling Reactions with Arenes→Stille Reaction; Cross Coupling Reactions with Arenes→Suzuki-Miyaura Coupling Reaction; Oxidation; Reduction;
Storage 2-8°C
Color Form crystalline
Complexity 272
Covalently-Bonded Unit Count 5
EC Number 610-654-4
Exact Mass 916.12077
Heavy Atom Count 56
Hydrogen Bond Acceptor Count 3
Monoisotopic Mass 914.12036
Rotatable Bond Count 12
Topological Polar Surface Area 51.2 Ų
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