ChemSpider 2D Image | 3-[AMINOETHYLPHOSPHORYL]-[1,2-DI-PALMITOYL]-SN-GLYCEROL | C37H74NO8P

3-[AMINOETHYLPHOSPHORYL]-[1,2-DI-PALMITOYL]-SN-GLYCEROL

  • Molecular FormulaC37H74NO8P
  • Average mass691.959 Da
  • Monoisotopic mass691.515198 Da
  • ChemSpider ID26329548

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-{[(S)-(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyl palmitate [ACD/IUPAC Name]
(2S)-3-{[(S)-(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propylpalmitat [German] [ACD/IUPAC Name]
3-[AMINOETHYLPHOSPHORYL]-[1,2-DI-PALMITOYL]-SN-GLYCEROL
Hexadecanoic acid, (1S)-1-[[[(S)-(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester [ACD/Index Name]
Palmitate de (2S)-3-{[(S)-(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
(2-aminoethoxy)[(2S)-2,3-bis(hexadecanoyloxy)propoxy]phosphinic acid
(R)-1-((((2-Aminoethoxy)hydroxyphosphinoyl)oxy)methyl)ethane-1,2-diyl dihexadecanoate
[(1R)-1-[(2-aminoethoxy-hydroxy-phosphoryl)oxymethyl]-2-hexadecanoyloxy-ethyl] hexadecanoate
[(2R)-1-(2-aminoethoxy-hydroxyphosphoryl)oxy-3-hexadecanoyloxypropan-2-yl] hexadecanoate
[(2R)-1-(2-aminoethoxy-hydroxy-phosphoryl)oxy-3-hexadecanoyloxy-propan-2-yl] hexadecanoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

LMGP02010037 [DBID]
P1348_SIGMA [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 723.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 115.1±6.0 kJ/mol
Flash Point: 391.4±35.7 °C
Index of Refraction: 1.474
Molar Refractivity: 192.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 2
ACD/LogP: 13.70
ACD/LogD (pH 5.5): 9.80
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 369216.22
ACD/LogD (pH 7.4): 9.71
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 297453.56
Polar Surface Area: 144 Å2
Polarizability: 76.3±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 684.7±3.0 cm3

Click to predict properties on the Chemicalize site


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