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Search term: KIHAGWUUUHJRMS-JOCHJYFZSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-octadecanoyl-sn-glycero-3-phosphoethanolamine | C23H48NO7P

2-octadecanoyl-sn-glycero-3-phosphoethanolamine

  • Molecular FormulaC23H48NO7P
  • Average mass481.603 Da
  • Monoisotopic mass481.316833 Da
  • ChemSpider ID24769218
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyl stearate [ACD/IUPAC Name]
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanylstearat [German] [ACD/IUPAC Name]
2-octadecanoyl-sn-glycero-3-phosphoethanolamine
2-octadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion
Octadecanoic acid, (1R)-2-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-1-(hydroxymethyl)ethyl ester [ACD/Index Name]
Stéarate de (2R)-1-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-3-hydroxy-2-propanyle [French] [ACD/IUPAC Name]
(2-aminoethoxy)[(2R)-3-hydroxy-2-(octadecanoyloxy)propoxy]phosphinic acid
(2R)-1-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxypropan-2-yl octadecanoate
1-Hydroxy-2-octadecanoyl-sn-glycero-3-phosphoethanolamine
1-Hydroxyl-2-stearoyl-sn-glycero-3-phosphoethanolamine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 597.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 102.1±6.0 kJ/mol
Flash Point: 315.1±32.9 °C
Index of Refraction: 1.481
Molar Refractivity: 127.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 6.73
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 54.45
ACD/KOC (pH 5.5): 118.40
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 43.98
ACD/KOC (pH 7.4): 95.62
Polar Surface Area: 138 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 447.6±3.0 cm3

Click to predict properties on the Chemicalize site






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