ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl icosanoate | C40H80NO8P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl icosanoate

  • Molecular FormulaC40H80NO8P
  • Average mass734.039 Da
  • Monoisotopic mass733.562134 Da
  • ChemSpider ID24768681

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl icosanoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl-icosanoat [German] [ACD/IUPAC Name]
Eicosanoic acid, (2R)-3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxopentadecyl)oxy]propyl ester [ACD/Index Name]
Icosanoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyle [French] [ACD/IUPAC Name]
(2-AMINOETHOXY)[(2R)-3-(ICOSANOYLOXY)-2-(PENTADECANOYLOXY)PROPOXY]PHOSPHINIC ACID
1-Arachidonyl-2-pentadecanoyl-sn-glycero-3-phosphoethanolamine
1-eicosanoyl-2-pentadecanoyl-glycero-3-phosphoethanolamine
2-AMINOETHOXY((2R)-3-(ICOSANOYLOXY)-2-(PENTADECANOYLOXY)PROPOXY)PHOSPHINIC ACID
2-aminoethoxy(2R)-3-(icosanoyloxy)-2-(pentadecanoyloxy)propoxyphosphinic acid
GPEtn(20:0/15:0)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.0±0.1 g/cm3
Boiling Point: 751.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 119.1±6.0 kJ/mol
Flash Point: 408.1±35.7 °C
Index of Refraction: 1.474
Molar Refractivity: 206.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 15.30
ACD/LogD (pH 5.5): 10.95
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1568763.88
ACD/LogD (pH 7.4): 10.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1263851.38
Polar Surface Area: 144 Å2
Polarizability: 81.8±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 734.2±3.0 cm3

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