Nickeltrifluoroacetylacetonate,dihydrate

• Catalog: OFC55534899
• CAS: 55534-89-9
• Category: Fluorinated Metal Complexes
• Synonyms: Nickel 1,1,1-Trifluoro 2,4-Pentanedionate
• Purity: 98%
• MDL Number: MFCD00150656

• IUPAC Name: nickel;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one;dihydrate
• InChI: InChI=1S/2C5H5F3O2.Ni.2H2O/c2*1-3(9)2-4(10)5(6,7)8;;;/h2*2,9H,1H3;;2*1H2/b2*3-2-
• InChI Key: BDZQXCVHZVPCDT-UDVCPWNYSA-N
• Isomeric SMILES: C/C(=C/C(=O)C(F)(F)F)/O.C/C(=C/C(=O)C(F)(F)F)/O.O.O.[Ni]

• Molecular Formula: C10H14F6NiO6
• Molecular Weight: 402.9
• Storage: Inert atmosphere, room temperature

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 2
• Exact Mass: 402.004799 g/mol
• Monoisotopic Mass: 402.004799 g/mol
• Topological Polar Surface Area: 76.6Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 382