ChemSpider 2D Image | O,O-Bis[(~2~H_5_)ethyl] O-[4-(methylsulfinyl)phenyl] phosphorothioate | C11H7D10O4PS2

O,O-Bis[(2H5)ethyl] O-[4-(methylsulfinyl)phenyl] phosphorothioate

  • Molecular FormulaC11H7D10O4PS2
  • Average mass318.416 Da
  • Monoisotopic mass318.093353 Da
  • ChemSpider ID58784690
  • Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

O,O-Bis[(2H5)ethyl] O-[4-(methylsulfinyl)phenyl] phosphorothioate [ACD/IUPAC Name]
O,O-Bis[(2H5)ethyl]-O-[4-(methylsulfinyl)phenyl]phosphorothioat [German] [ACD/IUPAC Name]
Phosphorothioate de O,O-bis[(2H5)éthyle] et de O-[4-(méthylsulfinyl)phényle] [French] [ACD/IUPAC Name]
Phosphorothioic acid, O,O-diethyl-d5 O-[4-(methylsulfinyl)phenyl] ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 404.0±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 198.2±29.3 °C
Index of Refraction: 1.576
Molar Refractivity: 77.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 47.91
ACD/KOC (pH 5.5): 555.20
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 47.91
ACD/KOC (pH 7.4): 555.20
Polar Surface Area: 106 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 235.0±5.0 cm3

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