trimagnesium(2+) ion diphosphate

• ChemBase ID: 128182
• Molecular Formular: Mg3O8P2
• Molecular Mass: 262.857722
• Monoisotopic Mass: 261.86196532
• SMILES: [O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2]
• Canonical SMILES: [O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2]
• InChI: InChI=1S/3Mg.2H3O4P/c;;;2*1-5(2,3)4/h;;;2*(H3,1,2,3,4)/q3*+2;;/p-6
• InChIKey: GVALZJMUIHGIMD-UHFFFAOYSA-H

NAMES AND DATABASE IDS

Names

• IUPAC name: trimagnesium(2+) ion diphosphate
• IUPAC Traditional name: trimagnesium(2+) ion diphosphate
• Synonyms: Trimagnesium diphosphate; Magnesium phosphate tribasic

Database IDs

• CAS Number: 10233-87-1
• PubChem SID: 162222494
• PubChem CID: 24439
• Wikipedia Title: Magnesium_phosphate_tribasic

CALCULATED PROPERTIES

• Acid pKa: 1.7961261
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -3.3916447
• LogD (pH = 7.4): -3.9718332
• Log P: -1.0201038
• Molar Refractivity: 11.2868 cm^3
• Polarizability: 5.564544 Å^3
• Polar Surface Area: 86.25 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Insoluble in water; Soluble in salt solution
• Apperance: White crystalline powder
• Melting Point: 1184°C
• Flash Point: N/A

Safety Information

• Risk Statements: R25, R36, R37, R38
• NFPA704:
  

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