ChemSpider 2D Image | 3-{[(1E)-1-Hydroxy-1-hexadecen-1-yl]oxy}-2-[(1-hydroxyvinyl)oxy]propyl 2-(trimethylammonio)ethyl phosphate | C26H52NO8P

3-{[(1E)-1-Hydroxy-1-hexadecen-1-yl]oxy}-2-[(1-hydroxyvinyl)oxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC26H52NO8P
  • Average mass537.667 Da
  • Monoisotopic mass537.343079 Da
  • ChemSpider ID95596796

More details:

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

3-{[(1E)-1-Hydroxy-1-hexadecen-1-yl]oxy}-2-[(1-hydroxyvinyl)oxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
3-{[(1E)-1-Hydroxy-1-hexadecen-1-yl]oxy}-2-[(1-hydroxyvinyl)oxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[2-[(1-hydroxyethenyl)oxy]-3-[[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de 3-{[(1E)-1-hydroxy-1-hexadécén-1-yl]oxy}-2-[(1-hydroxyvinyl)oxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]

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: 9
#H bond donors: 3
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 104.75
ACD/KOC (pH 5.5): 1439.26
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 103.18
ACD/KOC (pH 7.4): 1417.62
Polar Surface Area: 127 Å2
Polarizability:
Surface Tension:
Molar Volume:

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