DavePhos-Pd-G3
PRICE INQUIRYCatalog Number
ACM1445085879
Product Name
DavePhos-Pd-G3
Structure
![{[CurrentData.Name]}](https://resource.alfachemic.com/structure/1445085-87-9.gif)
CAS
1445085-87-9
Synonyms
[2-(Dicyclohexylphosphino)-2-(N,N-dimethylamino)-1,1-biphenyl]-2-(2-amino-1,1-biphenyl)]palladium(II) methanesulfonate
IUPAC Name
2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline;methanesulfonic acid;palladium;2-phenylaniline;
Molecular Weight
763.29
Molecular Formula
C39H49N2O3PPdS
Canonical SMILES
CN(C)C1=CC=CC=C1C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4.CS(=O)(=O)O.C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Pd];
InChI
InChI=1S/C26H36NP.C12H10N.CH4O3S.Pd/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h9-12,17-22H,3-8,13-16H2,1-2H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1;;;
InChI Key
AYDJJLODFHACTR-UHFFFAOYSA-N;
Melting Point
183-200 °C
Purity
98%
Appearance
Powder
Complexity
786
Covalently-Bonded Unit Count
4
Exact Mass
763.231g/mol
Formal Charge
-1
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
47
Monoisotopic Mass
763.231g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
92A^2
Application
DavePhos-Pd-G3 is designed to enhance the efficiency of cross-coupling reactions, building on the innovative work done by Buchwald and his team. By modifying the G3 precatalyst through the methylation of the amino group on the biphenyl backbone, it improves upon the second-generation precatalyst. This catalyst exhibits exceptional versatility and stability, maintaining a long lifespan in solution across a range of organic solvents. Particularly effective in C-N bond-forming reactions, DavePhos-Pd-G3 is a reliable choice for chemists seeking to optimize cross-coupling processes.
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