chlororutheniumylium pentaamine chloride

• ChemBase ID: 152937
• Molecular Formular: Cl2H15N5Ru
• Molecular Mass: 257.1286
• Monoisotopic Mass: 256.97479987
• SMILES: N.N.N.N.N.[Cl-].Cl[Ru+]
• Canonical SMILES: [Ru+]Cl.N.N.N.N.N.[Cl-]
• InChI: InChI=1S/2ClH.5H3N.Ru/h2*1H;5*1H3;/q;;;;;;;+2/p-2
• InChIKey: MEEVMUZSVXLKBU-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: chlororutheniumylium pentaamine chloride
• IUPAC Traditional name: chlororutheniumylium pentaamine chloride
• Synonyms: Chloropentaammineruthenium(II) chloride; 氯化五氨合氯钌(II)

Database IDs

• CAS Number: 137729-23-8
• MDL Number: MFCD07369711
• PubChem SID: 162247079; 24880757
• PubChem CID: 16217287

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.6345
• LogD (pH = 7.4): 0.6345
• Log P: 0.6345
• Molar Refractivity: 6.1363 cm^3
• Polarizability: 7.1523056 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: 314-315 °C(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 99.99% trace metals basis
• Empirical Formula (Hill Notation): H15Cl2N5Ru

DETAILS

Sigma Aldrich - 574767

Packaging
1 g in glass bottle