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Search term: YJTNFEAACCZQAS (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 6-Hydroxy-2-methyl-6-oxido-8-[(palmitoyloxy)methyl]-5,7-dioxa-2-aza-6lambda~5~-phosphanonan-9-yl palmitate | C39H78NO8P

6-Hydroxy-2-methyl-6-oxido-8-[(palmitoyloxy)methyl]-5,7-dioxa-2-aza-6λ5-phosphanonan-9-yl palmitate

  • Molecular FormulaC39H78NO8P
  • Average mass720.012 Da
  • Monoisotopic mass719.546509 Da
  • ChemSpider ID21436136

More details:






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

6-Hydroxy-2-methyl-6-oxido-8-[(palmitoyloxy)methyl]-5,7-dioxa-2-aza-6λ5-phosphanonan-9-yl palmitate [ACD/IUPAC Name]
6-Hydroxy-2-methyl-6-oxido-8-[(palmitoyloxy)methyl]-5,7-dioxa-2-aza-6λ5-phosphanonan-9-ylpalmitat [German] [ACD/IUPAC Name]
Hexadecanoic acid, 2-[[[2-(dimethylamino)ethoxy]hydroxyphosphinyl]oxy]-1,3-propanediyl ester [ACD/Index Name]
Palmitate de 6-hydroxy-2-méthyl-6-oxydo-8-[(palmitoyloxy)méthyl]-5,7-dioxa-2-aza-6λ5-phosphanonan-9-yle [French] [ACD/IUPAC Name]
1,3-Dihexadecanoylglycero-2-phospho-N,N-dimethylethanolamine
1,3-Dihexadecanoyl-glycero-2-phospho-N-methylethanolamine
1,3-Dipalmitoylglycero-2-phospho-N,N-dimethylethanolamine
1,3-Dipalmitoyl-glycero-2-phospho-N-methylethanolamine
96760-48-4 [RN]
D-6059
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 726.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 115.4±6.0 kJ/mol
Flash Point: 392.9±35.7 °C
Index of Refraction: 1.472
Molar Refractivity: 201.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 2
ACD/LogP: 14.63
ACD/LogD (pH 5.5): 10.69
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1121952.38
ACD/LogD (pH 7.4): 10.65
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1044690.50
Polar Surface Area: 121 Å2
Polarizability: 80.0±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 721.3±3.0 cm3

Click to predict properties on the Chemicalize site






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