ChemSpider 2D Image | (2S)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(~2~H_3_)methyl]ammonio}ethyl phosphate | C36H63D9NO8P

(2S)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(2H3)methyl]ammonio}ethyl phosphate

  • Molecular FormulaC36H63D9NO8P
  • Average mass686.988 Da
  • Monoisotopic mass686.556030 Da
  • ChemSpider ID107443977

  • 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

(2S)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(2H3)methyl]ammonio}ethyl phosphate [ACD/IUPAC Name]
(2S)-2,3-Bis(tetradecanoyloxy)propyl-2-{tris[(2H3)methyl]ammonio}ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[[(2S)-2,3-bis[(1-oxotetradecyl)oxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-tri(methyl-d3)-, inner salt [ACD/Index Name]
Phosphate de (2S)-2,3-bis(tetradecanoyloxy)propyle et de 2-{tris[(2H3)méthyl]ammonio}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: 1
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 8.75
ACD/LogD (pH 5.5): 7.91
ACD/BCF (pH 5.5): 849229.69
ACD/KOC (pH 5.5): 903831.75
ACD/LogD (pH 7.4): 7.91
ACD/BCF (pH 7.4): 849258.63
ACD/KOC (pH 7.4): 903862.50
Polar Surface Area: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

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