ChemSpider 2D Image | Diethyl [3-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl]phosphonate | C12H21N2O4P

Diethyl [3-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl]phosphonate

  • Molecular FormulaC12H21N2O4P
  • Average mass288.280 Da
  • Monoisotopic mass288.123901 Da
  • ChemSpider ID122652765

More details:

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

[3-(Tétrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [3-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl]phosphonate [ACD/IUPAC Name]
Diethyl-[3-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[3-(tetrahydro-2H-pyran-4-yl)-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: 1.2±0.1 g/cm3
Boiling Point: 436.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 218.0±27.3 °C
Index of Refraction: 1.505
Molar Refractivity: 70.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.11
ACD/KOC (pH 5.5): 95.79
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 4.11
ACD/KOC (pH 7.4): 95.76
Polar Surface Area: 83 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 47.5±5.0 dyne/cm
Molar Volume: 236.2±5.0 cm3

Click to predict properties on the Chemicalize site


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