ChemSpider 2D Image | O-(Hydroxy{3-[(4Z)-4-octadecenoyloxy]-2-(stearoyloxy)propoxy}phosphoryl)serine | C42H80NO10P

O-(Hydroxy{3-[(4Z)-4-octadecenoyloxy]-2-(stearoyloxy)propoxy}phosphoryl)serine

  • Molecular FormulaC42H80NO10P
  • Average mass790.059 Da
  • Monoisotopic mass789.552002 Da
  • ChemSpider ID29273242

  • Double-bond stereo - Double-bond stereo

More details:

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

4-Octadecenoic acid, 3-[[(2-amino-2-carboxyethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxooctadecyl)oxy]propyl ester, (4Z)- [ACD/Index Name]
O-(Hydroxy{3-[(4Z)-4-octadecenoyloxy]-2-(stearoyloxy)propoxy}phosphoryl)serin [German] [ACD/IUPAC Name]
O-(Hydroxy{3-[(4Z)-4-octadecenoyloxy]-2-(stearoyloxy)propoxy}phosphoryl)serine [ACD/IUPAC Name]
O-(Hydroxy{3-[(4Z)-4-octadecenoyloxy]-2-(stearoyloxy)propoxy}phosphoryl)sérine [French] [ACD/IUPAC Name]
Phosphatidylserine 18:1-18:0

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

Density: 1.0±0.1 g/cm3
Boiling Point: 816.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 128.9±6.0 kJ/mol
Flash Point: 447.4±37.1 °C
Index of Refraction: 1.486
Molar Refractivity: 217.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 3
ACD/LogP: 15.81
ACD/LogD (pH 5.5): 9.90
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 146920.31
ACD/LogD (pH 7.4): 9.80
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 115127.52
Polar Surface Area: 181 Å2
Polarizability: 86.1±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 755.8±3.0 cm3

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