ChemSpider 2D Image | O,O-Dimethyl (1-hydroxyethyl)phosphonothioate | C4H11O3PS

O,O-Dimethyl (1-hydroxyethyl)phosphonothioate

  • Molecular FormulaC4H11O3PS
  • Average mass170.167 Da
  • Monoisotopic mass170.016647 Da
  • ChemSpider ID61038887

More details:

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

(1-Hydroxyéthyl)phosphonothioate de O,O-diméthyle [French] [ACD/IUPAC Name]
O,O-Dimethyl (1-hydroxyethyl)phosphonothioate [ACD/IUPAC Name]
O,O-Dimethyl-(1-hydroxyethyl)phosphonothioat [German] [ACD/IUPAC Name]
Phosphonothioic acid, P-(1-hydroxyethyl)-, O,O-dimethyl ester [ACD/Index Name]
81041-27-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 196.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 50.3±6.0 kJ/mol
Flash Point: 72.5±27.9 °C
Index of Refraction: 1.491
Molar Refractivity: 39.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 2.71
ACD/KOC (pH 5.5): 71.08
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 2.71
ACD/KOC (pH 7.4): 71.08
Polar Surface Area: 81 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 137.2±3.0 cm3

Click to predict properties on the Chemicalize site


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