ChemSpider 2D Image | O-[2-(Diethylamino)ethyl] O-isobutyl methylphosphonothioate | C11H26NO2PS

O-[2-(Diethylamino)ethyl] O-isobutyl methylphosphonothioate

  • Molecular FormulaC11H26NO2PS
  • Average mass267.368 Da
  • Monoisotopic mass267.142181 Da
  • ChemSpider ID23254385

More details:

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

Méthylphosphonothioate de O-[2-(diéthylamino)éthyle] et de O-isobutyle [French] [ACD/IUPAC Name]
O-[2-(diethylamino)ethyl] O-(2-methylpropyl) methylphosphonothioate
O-[2-(Diethylamino)ethyl] O-isobutyl methylphosphonothioate [ACD/IUPAC Name]
O-[2-(Diethylamino)ethyl]-O-isobutyl-methylphosphonothioat [German] [ACD/IUPAC Name]
Phosphonothioic acid, P-methyl-, O-[2-(diethylamino)ethyl] O-(2-methylpropyl) ester [ACD/Index Name]
phosphonothioic acid, methyl-, O-isobutyl S-2-(N,N-diethylamino)ethyl ester

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

Density: 1.0±0.1 g/cm3
Boiling Point: 303.6±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 137.4±28.4 °C
Index of Refraction: 1.478
Molar Refractivity: 74.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.49
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 2.98
ACD/KOC (pH 7.4): 23.18
Polar Surface Area: 64 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 262.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement