zinc(2+) ion carbonate

• ChemBase ID: 102857
• Molecular Formular: CO3Zn
• Molecular Mass: 125.3889
• Monoisotopic Mass: 123.91388586
• SMILES: [Zn+2].[O-]C(=O)[O-]
• Canonical SMILES: [O-]C(=O)[O-].[Zn+2]
• InChI: InChI=1S/CH2O3.Zn/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2
• InChIKey: FMRLDPWIRHBCCC-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: zinc(2+) ion carbonate
• IUPAC Traditional name: zinc, ion (zn2+) CO3
• Synonyms: Carbonic acid zinc salt (1:1); ZINC CARBONATE

Database IDs

• CAS Number: 3486-35-9
• PubChem SID: 162090093
• PubChem CID: 19005

CALCULATED PROPERTIES

• Acid pKa: 6.0525417
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.142811
• LogD (pH = 7.4): -1.1138874
• Log P: 0.25005138
• Molar Refractivity: 31.1724 cm^3
• Polarizability: 3.6386902 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: FG3375000
• European Hazard Symbols: Nature polluting (N)
• UN Number: 3077
• Hazard Class: 9
• Packing Group: III
• Australian Hazchem: 2X
• Risk Statements: R:58
• Safety Statements: S:7/8-61
• Emergency Response Guidebook(ERG) Number: 171