ChemSpider 2D Image | (2R)-2-Acetoxy-3-[(10E)-10-octadecen-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate | C28H56NO7P

(2R)-2-Acetoxy-3-[(10E)-10-octadecen-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC28H56NO7P
  • Average mass549.721 Da
  • Monoisotopic mass549.379456 Da
  • ChemSpider ID24822934

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Acetoxy-3-[(10E)-10-octadecen-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-Acetoxy-3-[(10E)-10-octadecen-1-yloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[[(2R)-2-(acetyloxy)-3-[(10E)-10-octadecen-1-yloxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-acétoxy-3-[(10E)-10-octadécén-1-yloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
1-(10E-octadecenyl)-2-acetyl-sn-glycero-3-phosphocholine
PAF
PC(O-18:1(10E)/2:0)
PC(O-18:1/2:0)
PC(O-20:1)
Platelet-activating factor [Wiki]

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: 27
#Rule of 5 Violations: 1
ACD/LogP: 4.49
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 211.45
ACD/KOC (pH 5.5): 2379.68
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 211.46
ACD/KOC (pH 7.4): 2379.76
Polar Surface Area: 104 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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