ChemSpider 2D Image | S-[(Isopropylsulfanyl)methyl] O-propyl methylphosphonothioate | C8H19O2PS2

S-[(Isopropylsulfanyl)methyl] O-propyl methylphosphonothioate

  • Molecular FormulaC8H19O2PS2
  • Average mass242.339 Da
  • Monoisotopic mass242.056412 Da
  • ChemSpider ID21252737

More details:

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

Méthylphosphonothioate de S-[(isopropylsulfanyl)méthyle] et de O-propyle [French] [ACD/IUPAC Name]
Phosphonothioic acid, P-methyl-, S-[[(1-methylethyl)thio]methyl] O-propyl ester [ACD/Index Name]
S-[(Isopropylsulfanyl)methyl] O-propyl methylphosphonothioate [ACD/IUPAC Name]
S-[(Isopropylsulfanyl)methyl]-O-propyl-methylphosphonothioat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 293.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.2±3.0 kJ/mol
Flash Point: 131.3±27.9 °C
Index of Refraction: 1.492
Molar Refractivity: 63.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.31
ACD/KOC (pH 5.5): 300.42
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.31
ACD/KOC (pH 7.4): 300.42
Polar Surface Area: 87 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 219.4±3.0 cm3

Click to predict properties on the Chemicalize site


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