ChemSpider 2D Image | (2S)-3-Hydroxy-2-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate | C26H54NO7P

(2S)-3-Hydroxy-2-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC26H54NO7P
  • Average mass523.683 Da
  • Monoisotopic mass523.363770 Da
  • ChemSpider ID18953394

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-Hydroxy-2-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-(stearoyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2S)-3-hydroxy-2-[(1-oxooctadecyl)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2S)-3-hydroxy-2-(stearoyloxy)propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
4421-58-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 1
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 132.23
ACD/KOC (pH 5.5): 1700.48
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 132.23
ACD/KOC (pH 7.4): 1700.54
Polar Surface Area: 115 Å2
Polarizability:
Surface Tension:
Molar Volume:

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