ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(15Z)-15-tetracosenoyloxy]propyl (15Z)-15-tetracosenoate | C53H102NO8P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(15Z)-15-tetracosenoyloxy]propyl (15Z)-15-tetracosenoate

  • Molecular FormulaC53H102NO8P
  • Average mass912.353 Da
  • Monoisotopic mass911.734314 Da
  • ChemSpider ID24769213

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(15Z)-15-Tétracosénoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-[(15Z)-15-tetracosenoyloxy]propyle [French] [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(15Z)-15-tetracosenoyloxy]propyl (15Z)-15-tetracosenoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-[(15Z)-15-tetracosenoyloxy]propyl-(15Z)-15-tetracosenoat [German] [ACD/IUPAC Name]
15-Tetracosenoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-[[[(15Z)-1-oxo-15-tetracosen-1-yl]oxy]methyl]ethyl ester, (15Z)- [ACD/Index Name]
(2-aminoethoxy)[(2R)-2,3-bis[(15Z)-tetracos-15-enoyloxy]propoxy]phosphinic acid
1,2-Dinervonoyl-rac-glycero-3-phosphoethanolamine
2-aminoethoxy(2R)-2,3-bis[(15Z)-tetracos-15-enoyloxy]propoxyphosphinic acid
GPEtn(24:1/24:1)
GPEtn(24:1n9/24:1n9)
GPEtn(24:1w9/24:1w9)
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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: 861.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.9±6.0 kJ/mol
Flash Point: 475.0±37.1 °C
Index of Refraction: 1.482
Molar Refractivity: 266.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 53
#Rule of 5 Violations: 2
ACD/LogP: 21.17
ACD/LogD (pH 5.5): 15.20
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.11
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 144 Å2
Polarizability: 105.7±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 936.0±3.0 cm3

Click to predict properties on the Chemicalize site


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