ChemSpider 2D Image | 2,3-Bis[(9E,12E,15E)-9,12,15-octadecatrienoyloxy]propyl 2,3-dihydroxypropyl phosphate | C42H70O10P

2,3-Bis[(9E,12E,15E)-9,12,15-octadecatrienoyloxy]propyl 2,3-dihydroxypropyl phosphate

  • Molecular FormulaC42H70O10P
  • Average mass765.974 Da
  • Monoisotopic mass765.471191 Da
  • ChemSpider ID95709242

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

2,3-Bis[(9E,12E,15E)-9,12,15-octadecatrienoyloxy]propyl 2,3-dihydroxypropyl phosphate [ACD/IUPAC Name]
2,3-Bis[(9E,12E,15E)-9,12,15-octadecatrienoyloxy]propyl-2,3-dihydroxypropylphosphat [German] [ACD/IUPAC Name]
9,12,15-Octadecatrienoic acid, 1-[[[(2,3-dihydroxypropoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, ion(0-), (9E,12E,15E,9'E,12'E,15'E)- [ACD/Index Name]
Phosphate de 2,3-bis[(9E,12E,15E)-9,12,15-octadecatrienoyloxy]propyle et de 2,3-dihydroxypropyle [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 794.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.7±6.0 kJ/mol
Flash Point: 434.5±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 3
ACD/LogP: 11.72
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 1043.53
ACD/KOC (pH 5.5): 535.15
ACD/LogD (pH 7.4): 5.28
ACD/BCF (pH 7.4): 882.55
ACD/KOC (pH 7.4): 452.60
Polar Surface Area: 161 Å2
Polarizability:
Surface Tension:
Molar Volume:

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