zirconium(4+) ion dioxidandiide

• ChemBase ID: 302788
• Molecular Formular: O2Zr
• Molecular Mass: 123.2228
• Monoisotopic Mass: 121.89453324
• SMILES: [O-2].[O-2].[Zr+4]
• Canonical SMILES: [O-2].[O-2].[Zr+4]
• InChI: InChI=1S/2O.Zr/q2*-2;+4
• InChIKey: RVTZCBVAJQQJTK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: zirconium(4+) ion dioxidandiide
• IUPAC Traditional name: zirconium(4+) ion dioxidandiide
• Synonyms: Zirconium(IV) oxide, yttria stabilized; Zirconium oxide, yttria stabilized, polymeric precursor; Zirconium(IV) oxide, Puratronic®; Zirconium dioxide; Zirconia; Zirconium(IV) oxide; Zirconium(IV) oxide, calcia stabilized; Zirconium(IV) oxide, Aerosol Refractory Paint; Zirconium oxide, polymeric precursor; 氧化锆(IV),氧化钇做稳定剂; 氧化锆, 氧化钇做稳定剂, 聚合物前体; 氧化锆(IV), Puratronic®; 2%; 氧化锆(IV), 氧化钙做稳定剂; 氧化锆(IV), 气溶胶耐温涂料; 氧化锆(IV); 氧化锆, 聚合物前体

Database IDs

• CAS Number: 1314-23-4
• EC Number: 215-227-2
• MDL Number: MFCD00011310; MFCD00145546
• Merck Index: 1410180

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 13.1149 cm^3
• Polarizability: 1.8190874 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Insoluble in water. Soluble in sulfuric acid and hydrofluoric acid. Dissolves on heating in a mixture of 2 parts H2SO4 and 1 part water; Soluble in alcohols; Soluble in hexane, toluene, alcohol
• Apperance: 0.005-0.01 Micron Particles in Liquid; 0.1 Micron Particles in Liquid; 1 Micron APS Powder; -100 Mesh Powder; -100+325 Mesh Powder; -140+325 Mesh Powder; 15-25nm APS Powder, S.A. 20-30 m2/g; 3-12mm Sintered Lump; -325 Mesh Powder; -325 Mesh Powder, S.A. 100-200m2/g; Aerosol Spray Can; Liquid; Powder
• Melting Point: ca 2700°C
• Boiling Point: ca 5000°C
• Flash Point: -104°C(-155°F)
• Density: 1.26; 5.89

Safety Information

• RTECS: ZH8800000
• European Hazard Symbols: Corrosive (C); Highly flammable (F+); Irritant (Xi)
• UN Number: UN1950; UN1993; UN2790
• Hazard Class: 2.1; 3; 8
• Packing Group: III
• Risk Statements: 10-36/37/38; 12-36-66-67; 34; 36/37/38; 36/38
• Safety Statements: 20-23-26-36/37/39-45; 26-37; 26-37-60; 3-23-26-37-60; 7/9-16-26
• TSCA Listed: 否; 是
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Hazard statements: H220-H319-H336; H226-H315-H319-H335; H314-H318; H315-H319
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; P210-P261-P280-P305+P351+P338-P405-P501A; P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A; P280-P305+P351+P338-P302+P352-P321-P362-P332+P313

Product Information

• Purity: 18% in H2O, colloidal dispersion, stabilized with 1.3% yttrium oxide; 20% in H2O, colloidal dispersion; 99% (including 4% CaO); 99% (metals basis excluding Hf); 99% (metals basis excluding Hf), Hf 2-4%; 99.4% (metals basis excluding Hf); 99.5% (metals basis excluding Hf), Hf <100ppm; 99.7% (metals basis excluding Hf), Hf <75ppm; 99.8% (metals basis excluding Hf); 99.978% (metals basis); 99+% (metals basis excluding Hf), HfO