Found 12 results

Search term: C13H23N2O3PS (Found by molecular formula)
ChemSpider 2D Image | Diethyl [1-(cyclobutylmethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate | C13H23N2O3PS

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

  • Molecular FormulaC13H23N2O3PS
  • Average mass318.372 Da
  • Monoisotopic mass318.116699 Da
  • ChemSpider ID122658053

More details:

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

[1-(Cyclobutylméthyl)-3-(méthylsulfanyl)-1H-pyrazol-4-yl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [1-(cyclobutylmethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonate [ACD/IUPAC Name]
Diethyl-[1-(cyclobutylmethyl)-3-(methylsulfanyl)-1H-pyrazol-4-yl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[1-(cyclobutylmethyl)-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: 430.8±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 214.4±24.6 °C
Index of Refraction: 1.591
Molar Refractivity: 82.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.79
ACD/KOC (pH 5.5): 346.47
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.79
ACD/KOC (pH 7.4): 346.47
Polar Surface Area: 88 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 243.0±7.0 cm3

Click to predict properties on the Chemicalize site


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