ChemSpider 2D Image | (2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl pentadecanoate | C35H70NO8P

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl pentadecanoate

  • Molecular FormulaC35H70NO8P
  • Average mass663.906 Da
  • Monoisotopic mass663.483887 Da
  • ChemSpider ID7825757

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl pentadecanoate [ACD/IUPAC Name]
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyl-pentadecanoat [German] [ACD/IUPAC Name]
Pentadécanoate de (2R)-3-{[(2-aminoéthoxy)(hydroxy)phosphoryl]oxy}-2-(pentadecanoyloxy)propyle [French] [ACD/IUPAC Name]
Pentadecanoic acid, (1R)-1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester [ACD/Index Name]
(2-aminoethoxy)[(2R)-2,3-bis(pentadecanoyloxy)propoxy]phosphinic acid
1,2-Dipentadecanoyl-rac-glycero-3-phosphoethanolamine
1,2-dipentadecanoyl-sn-glycero-3-phosphoethanolamine
109032-52-2 [RN]
15:0 PE
2-aminoethoxy((2R)-2,3-bis(pentadecanoyloxy)propoxy)phosphinic acid
More...

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

110885 [DBID]
LMGP02010106 [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: 704.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 112.3±6.0 kJ/mol
Flash Point: 380.0±35.7 °C
Index of Refraction: 1.474
Molar Refractivity: 183.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 12.64
ACD/LogD (pH 5.5): 8.96
ACD/BCF (pH 5.5): 959201.31
ACD/KOC (pH 5.5): 129571.71
ACD/LogD (pH 7.4): 8.87
ACD/BCF (pH 7.4): 772766.31
ACD/KOC (pH 7.4): 104387.53
Polar Surface Area: 144 Å2
Polarizability: 72.6±0.5 10-24cm3
Surface Tension: 39.0±3.0 dyne/cm
Molar Volume: 651.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement