pentamagnesium(2+) ion tetrahydrate dihydroxide tetracarbonate

• ChemBase ID: 303161
• Molecular Formular: C4H10Mg5O18
• Molecular Mass: 467.6364
• Monoisotopic Mass: 465.91192198
• SMILES: C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.[OH-].[OH-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
• Canonical SMILES: [O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].[O-]C(=O)[O-].O.O.O.O.[OH-].[OH-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
• InChI: InChI=1S/4CH2O3.5Mg.6H2O/c4*2-1(3)4;;;;;;;;;;;/h4*(H2,2,3,4);;;;;;6*1H2/q;;;;5*+2;;;;;;/p-10
• InChIKey: YMKSTRLFWJQKFP-UHFFFAOYSA-D

NAMES AND DATABASE IDS

Names

• IUPAC name: pentamagnesium(2+) ion tetrahydrate dihydroxide tetracarbonate
• IUPAC Traditional name: pentamagnesium(2+) ion tetrahydrate dihydroxide tetracarbonate
• Synonyms: Magnesium carbonate, basic; Magnesium carbonate hydroxide; Magnesium carbonate tetrahydrate, Reagent Grade; 四水碱式碳酸镁, 试剂级

Database IDs

• CAS Number: 39409-82-0
• EC Number: 235-192-7
• MDL Number: MFCD00149783
• Merck Index: 145660

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

Physical Property

• Apperance: -325 Mesh Powder

Safety Information

• TSCA Listed: 是

Product Information

• Purity: MgO ≈40-43.5%