zinc(2+) ion oxozirconiumbis(olate)

• ChemBase ID: 112273
• Molecular Formular: O3ZnZr
• Molecular Mass: 204.6022
• Monoisotopic Mass: 201.81858986
• SMILES: [Zn+2].[O-][Zr](=O)[O-]
• Canonical SMILES: [O-][Zr](=O)[O-].[Zn+2]
• InChI: InChI=1S/3O.Zn.Zr/q;2*-1;+2
• InChIKey: UVQCSGKWCQEEJZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: zinc(2+) ion oxozirconiumbis(olate)
• IUPAC Traditional name: zinc, ion (zn2+) oxozirconiumbis(olate)
• Synonyms: ZINC ZIRCONATE

Database IDs

• CAS Number: 53807-65-1
• PubChem SID: 162097356
• PubChem CID: 25022302

CALCULATED PROPERTIES

• Acid pKa: 13.332832
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -1.4238
• LogD (pH = 7.4): -1.4238005
• Log P: -1.4238
• Molar Refractivity: 4.3287 cm^3
• Polarizability: 6.8657103 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05223237

MP Biomedicals Rare Chemical collection