2,6-Bis(N-pyrazolyl)pyridine Nickel(II) dichloride
Product Information
Molecular Formula
C11H9Cl2N5Ni
Molecular Weight
340.82
Description
2,6-Bis(N-pyrazolyl)pyridine nickel (II) dichloride is a Ni precatalyst that can be used in Negishi alkyl-alkyl cross-coupling, reductive cross-coupling of styrenyl aziridines, and dialkyl ether formation.
Synonyms
Nickel, dichloro[2,6-di(1H-pyrazol-1-yl-κN2)pyridine-κN]-; (bpp)NiCl2
IUPAC Name
dichloronickel2,6-di(pyrazol-1-yl)pyridine
SMILES
[Cl-][Ni+2]12([Cl-])[N]3=CC=CN3C4=CC=CC(N5C=CC=[N]51)=[N]42
InChI
InChI=1S/C11H9N5.2ClH.Ni/c1-4-10(15-8-2-6-12-15)14-11(5-1)16-9-3-7-13-16;;;/h1-9H;2*1H;/q;;;+2/p-2
InChI Key
WEAQWSFPQTYECK-UHFFFAOYSA-L
Melting Point
107.9-132.4°C (dec.)
Purity
≥95%
Appearance
Powder or Crystals
Application
Transition Metal Catalysts
Storage
Store at RT under inert atmosphere
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
338.958842 g/mol
Monoisotopic Mass
338.958842 g/mol
Topological Polar Surface Area
48.5Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
215
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
2
Compound Is Canonicalized
Yes
