ChemSpider 2D Image | 3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(tetradecanoyloxy)propyl heptadecanoate | C36H72NO8P

3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(tetradecanoyloxy)propyl heptadecanoate

  • Molecular FormulaC36H72NO8P
  • Average mass677.932 Da
  • Monoisotopic mass677.499573 Da
  • ChemSpider ID7825900

More details:

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

3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(tetradecanoyloxy)propyl heptadecanoate [ACD/IUPAC Name]
3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(tetradecanoyloxy)propyl-heptadecanoat [German] [ACD/IUPAC Name]
Heptadécanoate de 3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(tetradecanoyloxy)propyle [French] [ACD/IUPAC Name]
Heptadecanoic acid, 3-[[(2-aminoethoxy)hydroxyphosphinyl]oxy]-2-[(1-oxotetradecyl)oxy]propyl ester [ACD/Index Name]
1-heptadecanoyl-2-tetradecanoyl-sn-glycero-3-phosphoethanolamine
GPEtn(17:0/14:0)[U]

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

LMGP02010251 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 714.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 113.7±6.0 kJ/mol
Flash Point: 385.8±35.7 °C
Index of Refraction: 1.474
Molar Refractivity: 187.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 13.17
ACD/LogD (pH 5.5): 9.36
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 213008.20
ACD/LogD (pH 7.4): 9.27
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 171606.89
Polar Surface Area: 144 Å2
Polarizability: 74.4±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 668.2±3.0 cm3

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