ChemSpider 2D Image | 2-Acetoxy-3-(hexadecyloxy)propyl 4-(trimethylammonio)butyl phosphate | C28H58NO7P

2-Acetoxy-3-(hexadecyloxy)propyl 4-(trimethylammonio)butyl phosphate

  • Molecular FormulaC28H58NO7P
  • Average mass551.736 Da
  • Monoisotopic mass551.395081 Da
  • ChemSpider ID23197640

More details:

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

1-Butanaminium, 4-[[[2-(acetyloxy)-3-(hexadecyloxy)propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
2-(acetyloxy)-3-(hexadecyloxy)propyl 4-(trimethylammonio)butyl phosphate
2-Acetoxy-3-(hexadecyloxy)propyl 4-(trimethylammonio)butyl phosphate [ACD/IUPAC Name]
2-Acetoxy-3-(hexadecyloxy)propyl-4-(trimethylammonio)butylphosphat [German] [ACD/IUPAC Name]
Phosphate de 2-acétoxy-3-(hexadécyloxy)propyle et de 4-(triméthylammonio)butyle [French] [ACD/IUPAC Name]
{4-[(2-Acetoxy-3-hexadecyloxy-propoxy)-hydroxy-phosphoryloxy]-butyl}-trimethyl-ammonium

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: 28
#Rule of 5 Violations: 1
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 205.26
ACD/KOC (pH 5.5): 2329.53
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 205.27
ACD/KOC (pH 7.4): 2329.65
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

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