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Search term: 113376584 (Found by CSID)
ChemSpider 2D Image | O-{[(2R)-2-(Dodecanoyloxy)-3-(octadecyloxy)propoxy](hydroxy)phosphoryl}-L-serine | C36H72NO9P

O-{[(2R)-2-(Dodecanoyloxy)-3-(octadecyloxy)propoxy](hydroxy)phosphoryl}-L-serine

  • Molecular FormulaC36H72NO9P
  • Average mass693.932 Da
  • Monoisotopic mass693.494446 Da
  • ChemSpider ID113376584

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Dodecanoic acid, (1R)-2-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-1-[(octadecyloxy)methyl]ethyl ester [ACD/Index Name]
O-{[(2R)-2-(Dodecanoyloxy)-3-(octadecyloxy)propoxy](hydroxy)phosphoryl}-L-serin [German] [ACD/IUPAC Name]
O-{[(2R)-2-(Dodecanoyloxy)-3-(octadecyloxy)propoxy](hydroxy)phosphoryl}-L-serine [ACD/IUPAC Name]
O-{[(2R)-2-(Dodecanoyloxy)-3-(octadécyloxy)propoxy](hydroxy)phosphoryl}-L-sérine [French] [ACD/IUPAC Name]
1-octadecyl-2-dodecanoyl-glycero-3-phosphoserine
PS(O-18:0/12:0)
PS(O-30:0)

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

Density: 1.0±0.1 g/cm3
Boiling Point: 753.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 119.5±6.0 kJ/mol
Flash Point: 409.4±35.7 °C
Index of Refraction: 1.480
Molar Refractivity: 189.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 3
ACD/LogP: 13.45
ACD/LogD (pH 5.5): 8.13
ACD/BCF (pH 5.5): 128985.49
ACD/KOC (pH 5.5): 16022.37
ACD/LogD (pH 7.4): 8.03
ACD/BCF (pH 7.4): 101375.45
ACD/KOC (pH 7.4): 12592.69
Polar Surface Area: 164 Å2
Polarizability: 75.0±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 666.1±3.0 cm3

Click to predict properties on the Chemicalize site


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