λ2-cobalt(2+) ion dipotassium hexacyanoirontetrauide

• ChemBase ID: 295093
• Molecular Formular: C6CoFeK2N6
• Molecular Mass: 349.0792
• Monoisotopic Mass: 348.81398989
• SMILES: C(#N)[Fe-4](C#N)(C#N)(C#N)(C#N)C#N.[K+].[K+].[Co+2]
• Canonical SMILES: N#C[Fe-4](C#N)(C#N)(C#N)(C#N)C#N.[K+].[K+].[Co+2]
• InChI: InChI=1S/6CN.Co.Fe.2K/c6*1-2;;;;/q;;;;;;+2;-4;2*+1
• InChIKey: MHFFRXFWHQQQLA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: λ^2-cobalt(2+) ion dipotassium hexacyanoirontetrauide
• IUPAC Traditional name: λ^2-cobalt(2+) ion dipotassium ferrocyanide
• Synonyms: Potassium hexacyanocobalt(II) ferrate(II); 六氰基钴(II)铁(II)酸钾

Database IDs

• CAS Number: 12549-23-4
• MDL Number: MFCD00077807
• PubChem SID: 180680624
• PubChem CID: 15764057

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): -0.2594
• LogD (pH = 7.4): -0.2594
• Log P: -0.2594
• Molar Refractivity: 39.9336 cm^3
• Polarizability: 15.723072 Å^3
• Polar Surface Area: 142.74 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: X
• Risk Statements: 20/22-32
• Safety Statements: 9-36
• TSCA Listed: 是
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H332
• GHS Precautionary statements: P261-P301+P310-P321-P304+P340-P405-P501A