ChemSpider 2D Image | (2R)-2,3-Bis(palmitoyloxy)propyl phosphatato(2-) | C35H67O8P

(2R)-2,3-Bis(palmitoyloxy)propyl phosphatato(2-)

  • Molecular FormulaC35H67O8P
  • Average mass646.877 Da
  • Monoisotopic mass646.458435 Da
  • ChemSpider ID28639145

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2,3-Bis(palmitoyloxy)propyl phosphatato(2-) [ACD/IUPAC Name]
(2R)-2,3-Bis(palmitoyloxy)propylphosphat [German] [ACD/IUPAC Name]
Hexadecanoato(2-), (1R)-2-[(1-oxohexadecyl)oxy]-1-[(phosphonooxy)methyl]ethyl ester, ion(2-) [ACD/Index Name]
Phosphate de (2R)-2,3-bis(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
(2R)-2,3-bis(hexadecanoyloxy)propyl phosphate
(2R)-2,3-bis(palmitoyloxy)propyl phosphate
1,2-dihexadecanoyl-sn-glycero 3-phosphate
1,2-dihexadecanoyl-sn-glycero-3-phosphate
1,2-dihexadecanoyl-sn-glycerol-3-phosphate(2-)
1,2-Dipalmitoyl-3-sn-phosphatidic acid
More...
  • Miscellaneous

    • Chemical Class:

      A 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate(2-) in which the 1-acyl group is also hexadecanoyl; major species at pH 7.3. ChEBI CHEBI:72859

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

Density:
Boiling Point: 706.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 112.6±6.0 kJ/mol
Flash Point: 381.3±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 13.67
ACD/LogD (pH 5.5): 9.09
ACD/BCF (pH 5.5): 736542.00
ACD/KOC (pH 5.5): 60845.14
ACD/LogD (pH 7.4): 8.16
ACD/BCF (pH 7.4): 86661.30
ACD/KOC (pH 7.4): 7159.02
Polar Surface Area: 135 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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