ChemSpider 2D Image | 2-Aminoethyl 2-hydroxy-3-[(1E)-1-octadecen-1-yloxy]propyl hydrogen phosphate | C23H48NO6P

2-Aminoethyl 2-hydroxy-3-[(1E)-1-octadecen-1-yloxy]propyl hydrogen phosphate

  • Molecular FormulaC23H48NO6P
  • Average mass465.604 Da
  • Monoisotopic mass465.321930 Da
  • ChemSpider ID57507650

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Aminoethyl 2-hydroxy-3-[(1E)-1-octadecen-1-yloxy]propyl hydrogen phosphate [ACD/IUPAC Name]
2-Aminoethyl-2-hydroxy-3-[(1E)-1-octadecen-1-yloxy]propylhydrogenphosphat [German] [ACD/IUPAC Name]
Hydrogénophosphate de 2-aminoéthyle et de 2-hydroxy-3-[(1E)-1-octadécén-1-yloxy]propyle [French] [ACD/IUPAC Name]
Phosphoric acid, 2-aminoethyl 2-hydroxy-3-[(1E)-1-octadecen-1-yloxy]propyl ester [ACD/Index Name]
174062-73-8 [RN]
1-O-1'-(Z)-octadecenyl-2-hydroxy-sn-glycero-3-phosphoethanolaMine
2-AMINOETHOXY(2-HYDROXY-3-(OCTADEC-1-EN-1-YLOXY)PROPOXY)PHOSPHINIC ACID

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

Density: 1.0±0.1 g/cm3
Boiling Point: 581.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.9±6.0 kJ/mol
Flash Point: 305.7±32.9 °C
Index of Refraction: 1.485
Molar Refractivity: 127.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 1
ACD/LogP: 7.01
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 74.71
ACD/KOC (pH 5.5): 148.49
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 60.68
ACD/KOC (pH 7.4): 120.60
Polar Surface Area: 121 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 444.1±3.0 cm3

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