magnesium(2+) ion bis(2-methylprop-2-enoate)

• ChemBase ID: 108011
• Molecular Formular: C8H10MgO4
• Molecular Mass: 194.4676
• Monoisotopic Mass: 194.0429505
• SMILES: [Mg+2].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-]
• Canonical SMILES: CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].[Mg+2]
• InChI: InChI=1S/2C4H6O2.Mg/c2*1-3(2)4(5)6;/h2*1H2,2H3,(H,5,6);/q;;+2/p-2
• InChIKey: DZBOAIYHPIPCBP-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: magnesium(2+) ion bis(2-methylprop-2-enoate)
• IUPAC Traditional name: magnesium(2+) dimethacrylate
• Synonyms: MAGNESIUM METHACRYLATE

Database IDs

• CAS Number: 7095-16-1
• EC Number: 230-402-3
• PubChem SID: 162094045
• PubChem CID: 3084001

CALCULATED PROPERTIES

• Acid pKa: 4.850526
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.19176336
• LogD (pH = 7.4): -1.5789503
• Log P: 0.9284978
• Molar Refractivity: 32.4856 cm^3
• Polarizability: 8.284419 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

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

DETAILS

MP Biomedicals - 05205741

MP Biomedicals Rare Chemical collection