ChemSpider 2D Image | (2R)-2-Hydroxy-3-[(~2~H_35_)octadecanoyloxy]propyl 2-(trimethylammonio)ethyl phosphate | C26H19D35NO7P

(2R)-2-Hydroxy-3-[(2H35)octadecanoyloxy]propyl 2-(trimethylammonio)ethyl phosphate

  • Molecular FormulaC26H19D35NO7P
  • Average mass558.899 Da
  • Monoisotopic mass558.583496 Da
  • ChemSpider ID79413377

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2R)-2-Hydroxy-3-[(2H35)octadecanoyloxy]propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-Hydroxy-3-[(2H35)octadecanoyloxy]propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
327178-92-7 [RN]
Ethanaminium, 2-[[hydroxy[(2R)-2-hydroxy-3-[(1-oxooctadecyl-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-d35)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-hydroxy-3-[(2H35)octadecanoyloxy]propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
18:0-d35 Lyso PC
4,7R-dihydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,22,22,23,23,24,24,25,25,26,26,27,27,27-d35-1-aminium-10-14C, 4-oxide, inner salt

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): 2.84
ACD/BCF (pH 5.5): 117.96
ACD/KOC (pH 5.5): 1567.06
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 117.97
ACD/KOC (pH 7.4): 1567.11
Polar Surface Area: 115 Å2
Polarizability:
Surface Tension:
Molar Volume:

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