zinc(2+) ion phosphonate

• ChemBase ID: 111589
• Molecular Formular: HO3PZn
• Molecular Mass: 145.359901
• Monoisotopic Mass: 143.89547252
• SMILES: [Zn+2].[O-]P(=O)[O-]
• Canonical SMILES: [O-]P(=O)[O-].[Zn+2]
• InChI: InChI=1S/H3O3P.Zn/c1-4(2)3;/h4H,(H2,1,2,3);/q;+2/p-2
• InChIKey: NGFNIPDMIZZXLP-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: zinc(2+) ion phosphonate
• IUPAC Traditional name: zinc, ion (zn2+) phosphonate
• Synonyms: ZINC PHOSPHITE

Database IDs

• CAS Number: 14332-59-3
• PubChem SID: 162097215
• PubChem CID: 6328548

CALCULATED PROPERTIES

• Acid pKa: 2.069728
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -3.6855202
• LogD (pH = 7.4): -3.7435338
• Log P: -1.4498
• Molar Refractivity: 10.3287 cm^3
• Polarizability: 5.05521 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• RTECS: TA1302000
• European Hazard Symbols: Flammable (F)
• Risk Statements: R:15-17
• Safety Statements: S:7/8

DETAILS

MP Biomedicals - 05219962

MP Biomedicals Rare Chemical collection