cerium(3+) ion magnesium(2+) ion pentakis(nitrooxidane)

• ChemBase ID: 111690
• Molecular Formular: CeMgN5O15
• Molecular Mass: 474.4455
• Monoisotopic Mass: 473.82956903
• SMILES: [Mg+2].[Ce+3].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-]
• Canonical SMILES: [O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[Mg+2].[Ce+3]
• InChI: InChI=1S/Ce.Mg.5NO3/c;;5*2-1(3)4/q+3;+2;5*-1
• InChIKey: HBUYGPBZBTVHIA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cerium(3+) ion magnesium(2+) ion pentakis(nitrooxidane)
• IUPAC Traditional name: cerium(3+) magnesium(2+) pentanitronate
• Synonyms: CEROUS MAGNESIUM NITRATE

Database IDs

• PubChem SID: 162106591
• PubChem CID: 25021392

CALCULATED PROPERTIES

• Acid pKa: -1.3999903
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -2.3479722
• LogD (pH = 7.4): -2.3479848
• Log P: 0.028413763
• Molar Refractivity: 9.8534 cm^3
• Polarizability: 3.4222581 Å^3
• Polar Surface Area: 68.88 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Oxidising (O)
• Risk Statements: R:8
• Safety Statements: S:16-17-26-28

DETAILS

MP Biomedicals - 05220410

MP Biomedicals Rare Chemical collection