1,4-Bis(diphenylphosphino)butane-palladium(II) chloride

• CAS: 29964-62-3
• Catalog Number: ACM29964623-1
• Category: Palladium series catalysts
• Molecular Weight: 603.8
• Molecular Formula: C28H28Cl2P2Pd
• Synonyms: Dichloro[bis(1,4-diphenylphosphino)butane]palladium(II)
• IUPAC Name: dichloropalladium;4-diphenylphosphanylbutyl(diphenyl)phosphane
• Canonical SMILES: C1=CC=C(C=C1)P(CCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Pd]Cl
• InChI: InChI=1S/C28H28P2.2ClH.Pd/c1-5-15-25(16-6-1)29(26-17-7-2-8-18-26)23-13-14-24-30(27-19-9-3-10-20-27)28-21-11-4-12-22-28;/h1-12,15-22H,13-14,23-24H2;2*1H;/q;+2/p-2
• InChI Key: JQXJBXVWVPVTOO-UHFFFAOYSA-L
• Melting Point: 285-305 °C
• Appearance: White like powder
• Application: Catalyst for the Grignard coupling for regioand stereoselective monoalkylation and arylation of 1,1-dichloro-1-alkenes; ; Synthetic pyrethriods: catalyst for the Negishi coupling of (2,2-dihaloethenyl)cyclopropanecarboxylates
• Complexity: 364
• Covalently-Bonded Unit Count: 2
• Defined Atom Stereocenter Count: 0
• Exact Mass: 602.00781
• Heavy Atom Count: 33
• Hydrogen Bond Acceptor Count: 0
• Hydrogen Bond Donor Count: 0
• Monoisotopic Mass: 602.00781
• Rotatable Bond Count: 9
• Topological Polar Surface Area: 0 Ų