Found 17 results

Search term: C39H72NO9P (Found by molecular formula)
ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyl (10E,12Z)-9-oxo-10,12-octadecadienoate | C39H72NO9P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyl (10E,12Z)-9-oxo-10,12-octadecadienoate

  • Molecular FormulaC39H72NO9P
  • Average mass729.964 Da
  • Monoisotopic mass729.494446 Da
  • ChemSpider ID117217351

  • 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

(10E,12Z)-9-Oxo-10,12-octadécadiénoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyl (10E,12Z)-9-oxo-10,12-octadecadienoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(palmitoyloxy)propyl-(10E,12Z)-9-oxo-10,12-octadecadienoat [German] [ACD/IUPAC Name]
10,12-Octadecadienoic acid, 9-oxo-, (2R)-3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxohexadecyl)oxy]propyl ester, (10E,12Z)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 776.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.8 mmHg at 25°C
Enthalpy of Vaporization: 122.8±6.0 kJ/mol
Flash Point: 423.2±35.7 °C
Index of Refraction: 1.487
Molar Refractivity: 201.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 3
ACD/LogP: 11.40
ACD/LogD (pH 5.5): 7.79
ACD/BCF (pH 5.5): 122657.50
ACD/KOC (pH 5.5): 29727.30
ACD/LogD (pH 7.4): 7.69
ACD/BCF (pH 7.4): 98817.09
ACD/KOC (pH 7.4): 23949.33
Polar Surface Area: 161 Å2
Polarizability: 80.0±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 702.0±3.0 cm3

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