ChemSpider 2D Image | 3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(docosanoyloxy)propyl tricosanoate | C50H100NO8P

3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(docosanoyloxy)propyl tricosanoate

  • Molecular FormulaC50H100NO8P
  • Average mass874.305 Da
  • Monoisotopic mass873.718628 Da
  • ChemSpider ID7825843

More details:

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

3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(docosanoyloxy)propyl tricosanoate [ACD/IUPAC Name]
3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(docosanoyloxy)propyl-tricosanoat [German] [ACD/IUPAC Name]
Tricosanoate de 3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(docosanoyloxy)propyle [French] [ACD/IUPAC Name]
Tricosanoic acid, 3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxodocosyl)oxy]propyl ester [ACD/Index Name]
1-tricosanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine
GPEtn(23:0/22:0)[U]

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

LMGP02010194 [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: 838.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 132.2±6.0 kJ/mol
Flash Point: 460.6±37.1 °C
Index of Refraction: 1.474
Molar Refractivity: 252.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 52
#Rule of 5 Violations: 2
ACD/LogP: 20.61
ACD/LogD (pH 5.5): 15.21
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.12
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 144 Å2
Polarizability: 100.2±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 899.3±3.0 cm3

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