ChemSpider 2D Image | (2R)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(~2~H_3_)methyl]ammonio}(~2~H_4_)ethyl phosphate | C36H59D13NO8P

(2R)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(2H3)methyl]ammonio}(2H4)ethyl phosphate

  • Molecular FormulaC36H59D13NO8P
  • Average mass691.013 Da
  • Monoisotopic mass690.581177 Da
  • ChemSpider ID98645224

  • 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)-2,3-Bis(tetradecanoyloxy)propyl 2-{tris[(2H3)methyl]ammonio}(2H4)ethyl phosphate [ACD/IUPAC Name]
(2R)-2,3-Bis(tetradecanoyloxy)propyl-2-{tris[(2H3)methyl]ammonio}(2H4)ethylphosphat [German] [ACD/IUPAC Name]
3,5,9-Trioxa-4-phosphatricosan-1,1,2,2-d4-1-aminium, 4-hydroxy-N,N,N-tri(methyl-d3)-10-oxo-7-[(1-oxotetradecyl)oxy]-, inner salt, 4-oxide, (7R)-
326495-28-7 [RN]
Ethan-1,1,2,2-d4-aminium, 2-[[[(2R)-2,3-bis[(1-oxotetradecyl)oxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-tri(methyl-d3)-, inner salt [ACD/Index Name]
Phosphate de (2R)-2,3-bis(tetradecanoyloxy)propyle et de 2-{tris[(2H3)méthyl]ammonio}(2H4)éthyle [French] [ACD/IUPAC Name]
14:0 PC-d13

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:

Click to predict properties on the Chemicalize site


Advertisement