RuPhos Pd G3

• Catalog Number: ACM1445085777
• Product Name: RuPhos Pd G3
• CAS: 1445085-77-7
• Category: Palladium series catalysts
• Synonyms: SY072913; (2-Dicyclohexylphosphino-2',6'-diisopropoxy-1,1'-biphenyl)(2-(2'-amino-1,1'-biphenyl))palladium(II) methanesulfonate; RuPhos Pd G3; RuPhos-Pd-G3; MFCD22572684 (95%); Methanesulfonato(2-dicyclohexylphosphino-2 inverted exclamation mark ,6 inverted exclamation mark -di-i-propoxy-1,1 inverted exclamation mark -biphenyl)(2 inverted exclamation mark -amino-1,1 inverted exclamation mark -biphenyl-2-yl)palladium(II)
• IUPAC Name: dicyclohexyl-[2-[2,6-di(propan-2-yloxy)phenyl]phenyl]phosphane;methanesulfonic acid;palladium;2-phenylaniline
• Molecular Weight: 837.385g/mol
• Molecular Formula: C43H57NO5PPdS-
• Canonical SMILES: CC(C)OC1=C(C(=CC=C1)OC(C)C)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4.CS(=O)(=O)O.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Pd]
• InChI: InChI=1S/C30H43O2P.C12H10N.CH4O3S.Pd/c1-22(2)31-27-19-13-20-28(32-23(3)4)30(27)26-18-11-12-21-29(26)33(24-14-7-5-8-15-24)25-16-9-6-10-17-25;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h11-13,18-25H,5-10,14-17H2,1-4H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1
• InChI Key: GYTUQNMMIUJBSP-UHFFFAOYSA-N
• Application: Palladium catalyst used for facile, C-N cross-coupling reactions.; ; A practical synthesis of indoles via a Pd-catalyzed C-N ring formation.
• Complexity: 965
• Covalently-Bonded Unit Count: 4
• Exact Mass: 836.273g/mol
• Formal Charge: -1
• H-Bond Acceptor: 7
• H-Bond Donor: 2
• Heavy Atom Count: 52
• Monoisotopic Mass: 836.273g/mol
• Rotatable Bond Count: 9
• Topological Polar Surface Area: 107A^2