nickel(2+) ion dibromate

• ChemBase ID: 112696
• Molecular Formular: Br2NiO6
• Molecular Mass: 314.4978
• Monoisotopic Mass: 311.74150462
• SMILES: [Ni+2].[O-][Br](=O)=O.[O-][Br](=O)=O
• Canonical SMILES: [O-][Br](=O)=O.[O-][Br](=O)=O.[Ni+2]
• InChI: InChI=1S/2BrHO3.Ni/c2*2-1(3)4;/h2*(H,2,3,4);/q;;+2/p-2
• InChIKey: XCCVZTSVSXTDDO-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: nickel(2+) ion dibromate
• IUPAC Traditional name: nickel(2+) dibromate
• Synonyms: NICKEL BROMATE HEXAHYDRATE

Database IDs

• CAS Number: 14550-87-9
• PubChem SID: 162098349
• PubChem CID: 167113

CALCULATED PROPERTIES

• Acid pKa: -29.820747
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -2.1853838
• LogD (pH = 7.4): -2.1853838
• Log P: 0.19101496
• Molar Refractivity: 13.0639 cm^3
• Polarizability: 5.874396 Å^3
• Polar Surface Area: 57.2 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05225340

MP Biomedicals Rare Chemical collection