ChemSpider 2D Image | (2R)-3-(Heptanoyloxy)-2-(octyloxy)propyl 2-(trimethylammonio)ethyl phosphate | C23H48NO7P

(2R)-3-(Heptanoyloxy)-2-(octyloxy)propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC23H48NO7P
  • Average mass481.603 Da
  • Monoisotopic mass481.316833 Da
  • ChemSpider ID24822930

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-3-(Heptanoyloxy)-2-(octyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-(Heptanoyloxy)-2-(octyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-2-(octyloxy)-3-[(1-oxoheptyl)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-(heptanoyloxy)-2-(octyloxy)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: 8
#H bond donors: 1
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 31.08
ACD/KOC (pH 5.5): 603.25
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 31.09
ACD/KOC (pH 7.4): 603.28
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

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