butyl ethenyl(methyl)phosphinate

• ChemBase ID: 238475
• Molecular Formular: C7H15O2P
• Molecular Mass: 162.166561
• Monoisotopic Mass: 162.08096635
• SMILES: P(=O)(C=C)(OCCCC)C
• Canonical SMILES: CP(=O)(C=C)OCCCC
• InChI: InChI=1S/C7H15O2P/c1-4-6-7-9-10(3,8)5-2/h5H,2,4,6-7H2,1,3H3
• InChIKey: ZDTAXHZDWJQTNL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: butyl ethenyl(methyl)phosphinate
• IUPAC Traditional name: butyl ethenyl(methyl)phosphinate
• Synonyms: butyl ethenyl(methyl)phosphinate

Database IDs

• MDL Number: MFCD02177785
• PubChem SID: 164294385
• PubChem CID: 2785349

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.6055
• LogD (pH = 7.4): 1.6055
• Log P: 1.6055
• Molar Refractivity: 42.9914 cm^3
• Polarizability: 17.358625 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.95

Product Information

• Purity: 95%