Tetrakis(acetonitrile)copper(I) hexafluorophosphate

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Catalog Number
ACM64443056-1
Product Name
Tetrakis(acetonitrile)copper(I) hexafluorophosphate
Structure
Structure
CAS
64443-05-6
Category
Heterocyclic Organic Compound
Synonyms
Acetonitrile;copper(1+);hexafluorophosphate
IUPAC Name
acetonitrile;copper(1+);hexafluorophosphate;
Molecular Weight
372.72
Molecular Formula
C8H12CuF6N4P
Canonical SMILES
CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+]
InChI
InChI=1S/4C2H3N.Cu.F6P/c4*1-2-3;1-7(2,3,4,5)6/h4*1H3;/q;+1;-1
InChI Key
GNQXUMGHBSAQBV-UHFFFAOYSA-N
Melting Point
160 °C
Appearance
Solid
Application
Useful catalyst for the Ullmann synthesis.

Catalytic asymmetric [2,3]-Sigmatropic rearrangement of sulfur ylides.

Precatalyst for enantioselective N-H insertion reactions with diazoesters and anilines.
Complexity
92
Covalently-Bonded Unit Count
6
Exact Mass
371.999974
H-Bond Acceptor
11
Heavy Atom Count
20
Hydrogen Bond Acceptor Count
11
Hydrogen Bond Donor Count
0
Monoisotopic Mass
371.999974
Rotatable Bond Count
0
Topological Polar Surface Area
95.2 Ų
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