ChemSpider 2D Image | Diethyl [1-ethyl-5-hydroxy-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate | C10H19N2O4PS

Diethyl [1-ethyl-5-hydroxy-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate

  • Molecular FormulaC10H19N2O4PS
  • Average mass294.308 Da
  • Monoisotopic mass294.080322 Da
  • ChemSpider ID122670107

More details:

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

[1-Éthyl-5-hydroxy-3-(méthylsulfanyl)-1H-pyrazol-4-yl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [1-ethyl-5-hydroxy-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate [ACD/IUPAC Name]
Diethyl-[1-ethyl-5-hydroxy-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[1-ethyl-5-hydroxy-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: 414.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 204.5±28.7 °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: 1.24
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 3.21
ACD/KOC (pH 5.5): 76.94
ACD/LogD (pH 7.4): -0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.78
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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