ChemSpider 2D Image | Ethyl hydrogen {2-[4-(trifluoromethyl)phenyl]-2-propanyl}phosphonate | C12H16F3O3P

Ethyl hydrogen {2-[4-(trifluoromethyl)phenyl]-2-propanyl}phosphonate

  • Molecular FormulaC12H16F3O3P
  • Average mass296.223 Da
  • Monoisotopic mass296.078918 Da
  • ChemSpider ID74787509

More details:






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

Ethyl hydrogen {2-[4-(trifluoromethyl)phenyl]-2-propanyl}phosphonate [ACD/IUPAC Name]
Ethyl-hydrogen{2-[4-(trifluormethyl)phenyl]-2-propanyl}phosphonat [German] [ACD/IUPAC Name]
Hydrogéno{2-[4-(trifluorométhyl)phényl]-2-propanyl}phosphonate d'éthyle [French] [ACD/IUPAC Name]
Phosphonic acid, P-[1-methyl-1-[4-(trifluoromethyl)phenyl]ethyl]-, monoethyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 348.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 164.7±30.7 °C
Index of Refraction: 1.462
Molar Refractivity: 64.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

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