Bis(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionate)copper(II)

• Catalog Number: ACM80289210-2
• Product Name: Bis(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionate)copper(II)
• CAS: 80289-21-0
• Category: Organic Copper
• Synonyms: Copper bis(6,6,7,7,8,8,8-heptafluoro-2,2-diMethyl-3,5-octane
• IUPAC Name: Dicopper;(Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate
• Molecular Weight: 717.4
• Molecular Formula: C20H20Cu2F14O4
• Canonical SMILES: CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].[Cu+2].[Cu+2]
• InChI: InChI=1S/2C10H11F7O2.2Cu/c2*1-7(2,3)5(18)4-6(19)8(11,12)9(13,14)10(15,16)17;/h2*4,18H,1-3H3;/q;2*+2/p-2/b2*5-4-
• InChI Key: KYVXQSFIEOMONY-WSTITRFPSA-L
• Boiling Point: 280 °C
• Melting Point: 59-61 °C
• Appearance: Blue to purple powder
• Complexity: 388
• Covalently-Bonded Unit Count: 3
• Exact Mass: 715.972998
• Formal Charge: 0
• H-Bond Acceptor: 18
• H-Bond Donor: 0
• Heavy Atom Count: 40
• Hydrogen Bond Acceptor Count: 18
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.[Cu+2].[Cu+2]
• Monoisotopic Mass: 715.972998
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 80.3 Ų