copper(2+) ion diironoylolate

• ChemBase ID: 141966
• Molecular Formular: CuFe2O4
• Molecular Mass: 239.2336
• Monoisotopic Mass: 238.77913098
• SMILES: [O-][Fe]=O.[O-][Fe]=O.[Cu+2]
• Canonical SMILES: [O-][Fe]=O.[O-][Fe]=O.[Cu+2]
• InChI: InChI=1S/Cu.2Fe.4O/q+2;;;;;2*-1
• InChIKey: DXKGMXNZSJMWAF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: copper(2+) ion diironoylolate
• IUPAC Traditional name: copper(2+) ion diironoylolate
• Synonyms: Copper ferrite; Copper iron oxide; 铁酸铜; 氧化铁铜

Database IDs

• CAS Number: 12018-79-0
• MDL Number: MFCD00016056
• PubChem SID: 24883137; 162236198
• PubChem CID: 16217788

CALCULATED PROPERTIES

• Acid pKa: 3.0
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -2.5539775
• LogD (pH = 7.4): -2.748255
• Log P: -0.4876
• Molar Refractivity: 2.8858 cm^3
• Polarizability: 4.8020344 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: nanopowder
• Density: 5.4 g/mL at 25 °C(lit.)

Safety Information

• European Hazard Symbols: Nature polluting (N); Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 22-36/37/38-50/53
• Safety Statements: 26-61
• GHS Pictograms: GHS07; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H315-H319-H335-H410
• GHS Precautionary statements: P261-P273-P305 + P351 + P338-P501
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Product Information

• Purity: 98.5% trace metals basis
• Particle Size: <100 nm (BET)
• Linear Formula: CuFe2O4

DETAILS

Sigma Aldrich - 641723

Packaging
10 g in glass bottle