Palladium(II)(π-cinnamyl) Chloride Dimer

• CAS: 12131-44-1
• Catalog Number: ACM12131441
• Category: Palladium series catalysts
• Molecular Weight: 518.082g/mol
• Molecular Formula: C18H18Cl2Pd2
• Synonyms: 12131-44-1;Palladium(|Eth-cinnamyl) chloride dimer;AK136149;PALLADIUM(PI-CINNAMYL) CHLORIDE DIMER;Di- -chlorobis[(1,2,3- )-1-phenyl-2-propen-1-yl]dipalladium;Di-|I-chlorobis[(1,2,3-|C)-1-phenyl-2-propen-1-yl]dipalladium;Di-|I-chlorobis[(1,2,3-|C)-1-phenyl-2-propenyl]dipalladium(II);Di-mu-chlorobis[(1,2,3-eta)-1-phenyl-2-propen-1-yl]dipalladium
• IUPAC Name: palladium(2+);prop-2-enylbenzene;dichloride
• Canonical SMILES: C=C[CH-]C1=CC=CC=C1.C=C[CH-]C1=CC=CC=C1.[Cl-].[Cl-].[Pd+2].[Pd+2]
• InChI: InChI=1S/2C9H9.2ClH.2Pd/c2*1-2-6-9-7-4-3-5-8-9;;;;/h2*2-8H,1H2;2*1H;;/q2*-1;;;2*+2/p-2
• InChI Key: PHDNDSSMEIRHSI-UHFFFAOYSA-L
• Application: Precursor for the preparation of a palladium catalyst used in the carbonylative arylation of ketones, yielding vinylbenzoate compounds.; ; Precursor for the preparation of a palladium catalyst used in the Buchwald-Hartwig amination of (hetero)aryl chlorides.; ; Precursor for the preparation of a palladium catalyst used in the arylative dearomatization of phenols.; ; Versatile palladium precursor for the preparation of palladium catalysts used in the cross-coupling of aryl chlorides and amines , conversion of aryl triflates to aryl fluorides , and the α-arylation of aldehydes .
• Complexity: 78
• Covalently-Bonded Unit Count: 6
• Exact Mass: 517.886g/mol
• H-Bond Acceptor: 4
• Heavy Atom Count: 22
• Monoisotopic Mass: 515.886g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 0A^2