ChemSpider 2D Image | 1-DECYL-3-TRIFLUORO ETHYL-SN-GLYCERO-2-PHOSPHOMETHANOL | C16H32F3O6P

1-DECYL-3-TRIFLUORO ETHYL-SN-GLYCERO-2-PHOSPHOMETHANOL

  • Molecular FormulaC16H32F3O6P
  • Average mass408.391 Da
  • Monoisotopic mass408.188873 Da
  • ChemSpider ID25056656
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-1-(Decyloxy)-3-(2,2,2-trifluorethoxy)-2-propanyl-methylhydrogenphosphat [German] [ACD/IUPAC Name]
(2S)-1-(Decyloxy)-3-(2,2,2-trifluoroethoxy)-2-propanyl methyl hydrogen phosphate [ACD/IUPAC Name]
1-DECYL-3-TRIFLUORO ETHYL-SN-GLYCERO-2-PHOSPHOMETHANOL
Hydrogénophosphate de (2S)-1-(décyloxy)-3-(2,2,2-trifluoroéthoxy)-2-propanyle et de méthyle [French] [ACD/IUPAC Name]
Phosphoric acid, (1S)-2-(decyloxy)-1-[(2,2,2-trifluoroethoxy)methyl]ethyl methyl ester [ACD/Index Name]
[(2S)-1-(decyloxy)-3-(2,2,2-trifluoroethoxy)propan-2-yl]oxy(methoxy)phosphinic acid
{[(2S)-1-(decyloxy)-3-(2,2,2-trifluoroethoxy)propan-2-yl]oxy}(methoxy)phosphinic acid
GLE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 447.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±6.0 kJ/mol
Flash Point: 224.6±31.5 °C
Index of Refraction: 1.429
Molar Refractivity: 92.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.03
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.59
Polar Surface Area: 84 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 356.5±3.0 cm3

Click to predict properties on the Chemicalize site






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