Dichlorobis(trimethylphosphine)nickel(II)

Product Information

Molecular Formula:
[((CH3)3P)]2NICl2
Molecular Weight:
281.75
Description
Catalyst for:• Wenkert arylation of thiophene with aryl Grignard reagents• Regioselective [2+2+2] cycloaddition of carboryne with alkynes to give benzocarborane compounds• Kumada-Corriu cross coupling of Grignard reagents• Borylation of aryl chlorides• Reductive aldol cyclization-lactonization• Arylcyanation of alkynes• Alkynylation of benzonitriles via C-C bond activation
Synonyms
Bis(trimethylphosphine)nickel dichloride
IUPAC Name
dichloronickeltrimethylphosphane
Canonical SMILES
CP(C)C.CP(C)C.Cl[Ni]Cl
InChI
InChI=1S/2C3H9P.2ClH.Ni/c2*1-4(2)3/h2*1-3H32*1H/q+2/p-2
InChI Key
KYHNNWWCXIOTKC-UHFFFAOYSA-L
Melting Point
194-199 °C (lit.)
Flash Point
Not applicable
Purity
97%

Safety Information

Hazards
H302 + H312 + H332
Precautionary Statement
P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
0
Exact Mass
279.961422 g/mol
Monoisotopic Mass
279.961422 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
10.8
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

Patents

Publication Number Title Priority Date
CA-3032734-A1 Methods for cross coupling 2016-08-23
EP-3504217-A1 Methods for cross coupling 2016-08-23
JP-2019528296-A Cross coupling method 2016-08-23
KR-20190041485-A Cross coupling method 2016-08-23
US-2019202769-A1 Methods for cross coupling 2016-08-23
WO-2018039232-A1 Methods for cross coupling 2016-08-23
RU-2019104463-A METHODS OF CROSS COMBINATION 2016-08-23
US-10793504-B2 Methods for cross coupling 2016-08-23
CN-109661399-B Cross-coupling method 2016-08-23
WO-2017177921-A1 Liquid crystal polyester composition 2016-04-13
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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