[2,6-Bis[(di-1-piperidinylphosphino)amino]phenyl]palladium(II) chloride
Product Information
Molecular Formula
C26H45ClN6P2Pd
Molecular Weight
645.50
Description
Palladium catalyst for CC coupling reactions• Performs Suzuki reactions at low loadings• High activity at ppm levels for Heck reactions and Sonogashira couplings
Synonyms
[2,6-Bis[(di-1-piperidinylphosphino)amino]phenyl]palladium(II) chloride; (2,6-Bis((di(piperidin-1-yl)phosphino)amino)phenyl)palladium(II)chloride; 1-N,3-N-bis[di(piperidin-1-yl)phosphanyl]benzene-2-ide-1,3-diamine; palladium(2+); chloride
IUPAC Name
1-N,3-N-bis[di(piperidin-1-yl)phosphanyl]benzene-2-ide-1,3-diaminepalladium(2+)chloride
SMILES
C1CCN(CC1)P(NC2=[C-]C(=CC=C2)NP(N3CCCCC3)N4CCCCC4)N5CCCCC5.[Cl-].[Pd+2]
InChI
InChI=1S/C26H45N6P2.ClH.Pd/c1-5-16-29(17-6-1)33(30-18-7-2-8-19-30)27-25-14-13-15-26(24-25)28-34(31-20-9-3-10-21-31)32-22-11-4-12-23-32/h13-15,27-28H,1-12,16-23H21H/q-1+2/p-1
InChI Key
XASCRSOQTJTSCW-UHFFFAOYSA-M
Purity
≥98.0% (AT)
Safety Information
Hazards
H315
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
8
Rotatable Bond Count
8
Exact Mass
644.19043 g/mol
Monoisotopic Mass
644.19043 g/mol
Topological Polar Surface Area
37Ų
Heavy Atom Count
36
Formal Charge
0
Complexity
628
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
3
Compound Is Canonicalized
Yes
