ChemSpider 2D Image | 2,3-Dihydroxypropyl 3-[(9E)-9-octadecenoyloxy]-2-(palmitoyloxy)propyl phosphate | C40H76O10P

2,3-Dihydroxypropyl 3-[(9E)-9-octadecenoyloxy]-2-(palmitoyloxy)propyl phosphate

  • Molecular FormulaC40H76O10P
  • Average mass748.000 Da
  • Monoisotopic mass747.518188 Da
  • ChemSpider ID24785616

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

2,3-Dihydroxypropyl 3-[(9E)-9-octadecenoyloxy]-2-(palmitoyloxy)propyl phosphate [ACD/IUPAC Name]
2,3-Dihydroxypropyl-3-[(9E)-9-octadecenoyloxy]-2-(palmitoyloxy)propylphosphat [German] [ACD/IUPAC Name]
9-Octadecenoic acid, 3-[[(2,3-dihydroxypropoxy)hydroxyphosphinyl]oxy]-2-[(1-oxohexadecyl)oxy]propyl ester, ion(1-), (9E)- [ACD/Index Name]
Phosphate de 2,3-dihydroxypropyle et de 3-[(9E)-9-octadecenoyloxy]-2-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
18:1-16:0-PG
18:1-16:0-PG*1-18:1-2-16:0-phosphatidylglycerol

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

Density:
Boiling Point: 778.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.1 mmHg at 25°C
Enthalpy of Vaporization: 129.2±6.0 kJ/mol
Flash Point: 424.9±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 41
#Rule of 5 Violations: 3
ACD/LogP: 13.57
ACD/LogD (pH 5.5): 8.65
ACD/BCF (pH 5.5): 330407.66
ACD/KOC (pH 5.5): 32986.79
ACD/LogD (pH 7.4): 8.57
ACD/BCF (pH 7.4): 279438.16
ACD/KOC (pH 7.4): 27898.17
Polar Surface Area: 161 Å2
Polarizability:
Surface Tension:
Molar Volume:

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