ChemSpider 2D Image | Diethyl [1-(1-hydroxyethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate | C10H19N2O4PS

Diethyl [1-(1-hydroxyethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate

  • Molecular FormulaC10H19N2O4PS
  • Average mass294.308 Da
  • Monoisotopic mass294.080322 Da
  • ChemSpider ID122657881

More details:

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

[1-(1-Hydroxyéthyl)-3-(méthylsulfanyl)-1H-pyrazol-4-yl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [1-(1-hydroxyethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate [ACD/IUPAC Name]
Diethyl-[1-(1-hydroxyethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[1-(1-hydroxyethyl)-3-(methylthio)-1H-pyrazol-4-yl]-, diethyl 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: 411.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.0±3.0 kJ/mol
Flash Point: 202.4±27.3 °C
Index of Refraction: 1.564
Molar Refractivity: 71.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.66
ACD/KOC (pH 5.5): 50.02
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 1.66
ACD/KOC (pH 7.4): 50.02
Polar Surface Area: 109 Å2
Polarizability: 28.3±0.5 10-24cm3
Surface Tension: 48.9±7.0 dyne/cm
Molar Volume: 219.7±7.0 cm3

Click to predict properties on the Chemicalize site


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