Found 1 result

Search term: 59652352 (Found by CSID)
ChemSpider 2D Image | 1-(Palmitoyloxy)-3-(tetradecanoyloxy)-2-propanyl (8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoate | C53H94O6

1-(Palmitoyloxy)-3-(tetradecanoyloxy)-2-propanyl (8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoate

  • Molecular FormulaC53H94O6
  • Average mass827.310 Da
  • Monoisotopic mass826.705017 Da
  • ChemSpider ID59652352

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(8Z,11Z,14Z,17Z)-8,11,14,17-Icosatétraénoate de 1-(palmitoyloxy)-3-(tetradecanoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
1-(Palmitoyloxy)-3-(tetradecanoyloxy)-2-propanyl (8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoate [ACD/IUPAC Name]
1-(Palmitoyloxy)-3-(tetradecanoyloxy)-2-propanyl-(8Z,11Z,14Z,17Z)-8,11,14,17-icosatetraenoat [German] [ACD/IUPAC Name]
8,11,14,17-Eicosatetraenoic acid, 2-[(1-oxohexadecyl)oxy]-1-[[(1-oxotetradecyl)oxy]methyl]ethyl ester, (8Z,11Z,14Z,17Z)- [ACD/Index Name]
(2S)-1-(hexadecanoyloxy)-3-(tetradecanoyloxy)propan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate
1-Myristoyl-2-eicsoatetraenoyl-3-palmitoyl-glycerol
1-Tetradecanoyl-2-(8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-hexadecanoyl-glycerol
TAG(14:0/20:4/16:0)
TAG(50:4)
TG(14:0/20:4(8Z,11Z,14Z,17Z)/16:0)
More...

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

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

Density: 0.9±0.1 g/cm3
Boiling Point: 783.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.9±3.0 kJ/mol
Flash Point: 294.3±32.9 °C
Index of Refraction: 1.481
Molar Refractivity: 253.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 48
#Rule of 5 Violations: 2
ACD/LogP: 20.75
ACD/LogD (pH 5.5): 19.00
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 19.00
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 100.3±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 888.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement