triethyl-$l^{5}-phosphanethione

• ChemBase ID: 83004
• Molecular Formular: C6H15PS
• Molecular Mass: 150.222061
• Monoisotopic Mass: 150.06320811
• SMILES: P(=S)(CC)(CC)CC
• Canonical SMILES: CCP(=S)(CC)CC
• InChI: InChI=1S/C6H15PS/c1-4-7(8,5-2)6-3/h4-6H2,1-3H3
• InChIKey: WTNQHMJTIHJURG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: triethyl-$l^{5}-phosphanethione
• IUPAC Traditional name: triethyl-$l^{5}-phosphanethione
• Synonyms: triethylphosphine sulphide

Database IDs

• CAS Number: 597-51-3
• MDL Number: MFCD00014462
• PubChem SID: 162070123
• PubChem CID: 301283

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.32100126
• LogD (pH = 7.4): 0.32100126
• Log P: 0.32100126
• Molar Refractivity: 46.4671 cm^3
• Polarizability: 18.452036 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true