triethenylphosphane

• ChemBase ID: 179350
• Molecular Formular: C6H9P
• Molecular Mass: 112.109421
• Monoisotopic Mass: 112.04418692
• SMILES: C=CP(C=C)C=C
• Canonical SMILES: C=CP(C=C)C=C
• InChI: InChI=1S/C6H9P/c1-4-7(5-2)6-3/h4-6H,1-3H2
• InChIKey: OZHUWVSXUOMDDU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: triethenylphosphane
• IUPAC Traditional name: triethenylphosphane
• Synonyms: Triethenylphosphine; Trivinylphosphine

Database IDs

• CAS Number: 3746-01-8
• PubChem SID: 164235260
• PubChem CID: 77348

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.5093829
• LogD (pH = 7.4): 0.683268
• Log P: 1.9241
• Molar Refractivity: 38.457 cm^3
• Polarizability: 13.812483 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

DETAILS

Toronto Research Chemicals - T891800

A vinylphosphorus compound as crosslinking agent.

REFERENCES

• van Leeuwen, P., et al.: Chem. Rev., 100, 2741 (2000)