ChemSpider 2D Image | 2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine | C29H56NO10P

2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine

  • Molecular FormulaC29H56NO10P
  • Average mass609.729 Da
  • Monoisotopic mass609.364197 Da
  • ChemSpider ID26332393

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-[(4-Carboxybutanoyl)oxy]-3-(palmitoyloxy)propyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-2-[(4-Carboxybutanoyl)oxy]-3-(palmitoyloxy)propyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine
Ethanaminium, 2-[[[(2R)-2-(4-carboxy-1-oxobutoxy)-3-[(1-oxohexadecyl)oxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-2-[(4-carboxybutanoyl)oxy]-3-(palmitoyloxy)propyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2R)-2-[(4-Carboxybutanoyl)oxy]-3-(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
(2R)-2-[(4-carboxybutanoyl)oxy]-3-(palmitoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
[(2R)-2-(4-carboxybutanoyloxy)-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
[89947-79-5] [RN]
1-hexadecanoyl-2-glutaroyl-sn-glycero-3-phosphocholine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 2
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 19.65
ACD/KOC (pH 5.5): 274.53
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 10.02
ACD/KOC (pH 7.4): 139.93
Polar Surface Area: 158 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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