methyl methylphosphinate

• ChemBase ID: 111550
• Molecular Formular: C2H7O2P
• Molecular Mass: 94.049541
• Monoisotopic Mass: 94.01836609
• SMILES: COP(=O)C
• Canonical SMILES: COP(=O)C
• InChI: InChI=1S/C2H7O2P/c1-4-5(2)3/h5H,1-2H3
• InChIKey: SZZFZADQWWRRTI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl methylphosphinate
• IUPAC Traditional name: methyl methylphosphinate
• Synonyms: DIMETHYLPHOSPHINIC ACID

Database IDs

• CAS Number: 3283-12-3
• EC Number: 221-927-9
• PubChem SID: 162089618
• PubChem CID: 14184540

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.459
• LogD (pH = 7.4): -0.459
• Log P: -0.459
• Molar Refractivity: 20.4355 cm^3
• Polarizability: 8.474021 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 85°C