hexaaminocobalttris(ylium)

• ChemBase ID: 3037
• Molecular Formular: CoH12N6+++
• Molecular Mass: 155.06868
• Monoisotopic Mass: 155.04553941
• SMILES: N[Co+3](N)(N)(N)(N)N
• Canonical SMILES: N[Co+3](N)(N)(N)(N)N
• InChI: InChI=1S/Co.6H2N/h;6*1H2/q+9;6*-1
• InChIKey: QRZXATGLRMBRQI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: hexaaminocobalttris(ylium)
• IUPAC Traditional name: @cobalt hexammine ion
• Synonyms: Cobalt Hexammine Ion

Database IDs

• PubChem SID: 46506427; 160966484
• PubChem CID: 5150142

CALCULATED PROPERTIES

• H Acceptors: 6
• H Donor: 6
• LogD (pH = 5.5): -2.5210056
• LogD (pH = 7.4): -2.4340286
• Log P: -2.4328
• Molar Refractivity: 31.7046 cm^3
• Polarizability: 14.477348 Å^3
• Polar Surface Area: 156.12 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

DETAILS

DrugBank - DB03350

Drug information: experimental