ChemSpider 2D Image | (2R)-2,3-Bis(palmitoyloxy)propyl 2,3-dihydroxypropyl phosphate | C38H74O10P

(2R)-2,3-Bis(palmitoyloxy)propyl 2,3-dihydroxypropyl phosphate

  • Molecular FormulaC38H74O10P
  • Average mass721.963 Da
  • Monoisotopic mass721.502502 Da
  • ChemSpider ID34999627

  • Charge - Charge

    defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-2,3-Bis(palmitoyloxy)propyl 2,3-dihydroxypropyl phosphate [ACD/IUPAC Name]
(2R)-2,3-Bis(palmitoyloxy)propyl-2,3-dihydroxypropylphosphat [German] [ACD/IUPAC Name]
Hexadecanoic acid, (1R)-1-[[[(2,3-dihydroxypropoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, ion(0-) [ACD/Index Name]
Phosphate de (2R)-2,3-bis(palmitoyloxy)propyle et de 2,3-dihydroxypropyle [French] [ACD/IUPAC Name]
(2R)-2,3-bis(hexadecanoyloxy)propyl 2,3-dihydroxypropyl phosphate
1,2-dihexadecanoyl-sn-glycero-3-phospho-glycerol
1,2-dihexadecanoyl-sn-glycero-3-phosphoglycerol(1-)
1,2-dipalmitoyl-sn-glycero-3-phosphoglycerol(1-)
  • Miscellaneous

    • Chemical Class:

      A phosphatidylglycerol(1-) that is the conjugate base of 1,2-dihexadecanoyl-sn-glycero-3-phosphoglycerol obtained by deprotonation of the phosphate hydroxy group; major species at ; pH 7.3. ChEBI CHEBI:85270
      A phosphatidylglycerol(1-) that is the conjugate base of 1,2-dihexadecanoyl-sn-glycero-3-phosphoglycerol obtained by deprotonation of the phosphate hydroxy group; major species at pH 7.3. ChEBI CHEBI:85270

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

Density:
Boiling Point: 761.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.8 mmHg at 25°C
Enthalpy of Vaporization: 126.5±6.0 kJ/mol
Flash Point: 414.4±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 3
ACD/LogP: 13.03
ACD/LogD (pH 5.5): 8.44
ACD/BCF (pH 5.5): 228558.23
ACD/KOC (pH 5.5): 25338.20
ACD/LogD (pH 7.4): 8.36
ACD/BCF (pH 7.4): 193300.28
ACD/KOC (pH 7.4): 21429.46
Polar Surface Area: 161 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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