Tetrakis(acetonitrile)copper(I) hexafluorophosphate

• CAS: 64443-05-6
• Catalog Number: ACM64443056-1
• Category: Other Products
• Molecular Weight: 372.72
• Molecular Formula: C8H12CuF6N4P
• Synonyms: Acetonitrile;copper(1+);hexafluorophosphate
• IUPAC Name: acetonitrile;copper(1+);hexafluorophosphate
• 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