2-(2'-Di-tert-butylphosphine)biphenylpalladium(II) acetate

• Catalog Number: ACM577971198
• Product Name: 2-(2'-Di-tert-butylphosphine)biphenylpalladium(II) acetate
• CAS: 577971-19-8
• Category: Heterocyclic Organic Compound
• Synonyms: ACETATO(2'-DI-T-BUTYLPHOSPHINO-1,1'-BIPHENYL-2-YL)PALLADIUM(II); 2-(2 inverted exclamation marka-Di-tert-butylphosphine)biphenylpalladium(II) acetate; SC10488; Palladium, (acetato-KappaO) [2'-[bis (1,1 dimethylethyl) phosphino-KappaP] [1,1'-biphenyl]-2-yl KappaC]; IEYDYAASBZOBOC-UHFFFAOYSA-M; Palladium, (acetato-| feminineO) [2 inverted exclamation marka-[bis (1,1 dimethylethyl) phosphino-| feminineP] [1,1 inverted exclamation marka-biphenyl]-2-yl | feminineC]; PALLADACYCLE; 577971-19-8
• IUPAC Name: acetic acid;ditert-butyl-(2-phenylphenyl)phosphane;palladium
• Molecular Weight: 463.874g/mol
• Molecular Formula: C22H30O2PPd-
• Canonical SMILES: CC(=O)O.CC(C)(C)P(C1=CC=CC=C1C2=CC=CC=[C-]2)C(C)(C)C.[Pd]
• InChI: InChI=1S/C20H26P.C2H4O2.Pd/c1-19(2,3)21(20(4,5)6)18-15-11-10-14-17(18)16-12-8-7-9-13-16;1-2(3)4;/h7-12,14-15H,1-6H3;1H3,(H,3,4);/q-1
• InChI Key: AGTIJKLADGVFEL-UHFFFAOYSA-N
• Application: Air and thermally stable, one-component precatalyst for the amination of aryl halides.
• Complexity: 521
• Covalently-Bonded Unit Count: 3
• Exact Mass: 463.102g/mol
• Formal Charge: -1
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Heavy Atom Count: 26
• Monoisotopic Mass: 463.102g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 37.3A^2