tetrapotassium hexacyanorutheniumtetrauide hydrate

• ChemBase ID: 148882
• Molecular Formular: C6H2K4N6ORu
• Molecular Mass: 431.58288
• Monoisotopic Mass: 431.78818443
• SMILES: C(#N)[Ru-4](C#N)(C#N)(C#N)(C#N)C#N.O.[K+].[K+].[K+].[K+]
• Canonical SMILES: N#C[Ru-4](C#N)(C#N)(C#N)(C#N)C#N.O.[K+].[K+].[K+].[K+]
• InChI: InChI=1S/6CN.4K.H2O.Ru/c6*1-2;;;;;;/h;;;;;;;;;;1H2;/q;;;;;;4*+1;;-4
• InChIKey: MOWAXRNETQBNPU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrapotassium hexacyanorutheniumtetrauide hydrate
• IUPAC Traditional name: tetrapotassium hexacyanorutheniumtetrauide hydrate
• Synonyms: Potassium hexacyanoruthenate(II) hydrate; 六氰基钌(II)酸钾 水合物

Database IDs

• CAS Number: 339268-21-2
• MDL Number: MFCD00150398
• PubChem SID: 162243054; 24863548
• PubChem CID: 71311369

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 0
• LogD (pH = 5.5): -0.6594
• LogD (pH = 7.4): -0.6594
• Log P: -0.6594
• Molar Refractivity: 39.9336 cm^3
• Polarizability: 17.203081 Å^3
• Polar Surface Area: 142.74 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• European Hazard Symbols: Toxic (T)
• UN Number: 1588
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 23/24/25-36/37/38
• Safety Statements: 26-36/37/39-45
• GHS Pictograms: GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H311-H315-H319-H331-H335
• GHS Precautionary statements: P261-P280-P301 + P310-P305 + P351 + P338-P311
• Personal Protective Equipment: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 1588 6.1/PG 2

Product Information

• Linear Formula: K4Ru(CN)6·xH2O

DETAILS

Sigma Aldrich - 378232

Packaging
2.5 g in glass bottle
500 mg in glass bottle