ChemSpider 2D Image | DG(18:3(9Z,12Z,15Z)/16:0/0:0) | C37H66O5

DG(18:3(9Z,12Z,15Z)/16:0/0:0)

  • Molecular FormulaC37H66O5
  • Average mass590.917 Da
  • Monoisotopic mass590.491028 Da
  • ChemSpider ID24766051

  • 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

(2S)-3-Hydroxy-2-(palmitoyloxy)propyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate [ACD/IUPAC Name]
(2S)-3-Hydroxy-2-(palmitoyloxy)propyl-(9Z,12Z,15Z)-9,12,15-octadecatrienoat [German] [ACD/IUPAC Name]
(9Z,12Z,15Z)-9,12,15-Octadécatriénoate de (2S)-3-hydroxy-2-(palmitoyloxy)propyle [French] [ACD/IUPAC Name]
9,12,15-Octadecatrienoic acid, (2S)-3-hydroxy-2-[(1-oxohexadecyl)oxy]propyl ester, (9Z,12Z,15Z)- [ACD/Index Name]
DG(18:3(9Z,12Z,15Z)/16:0/0:0)
(2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
1-a-Linolenoyl-2-palmitoyl-sn-glycerol
1-α-Linolenoyl-2-palmitoyl-sn-glycerol
DAG(18:3/16:0)
DAG(18:3n3/16:0)
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: 649.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.7±6.0 kJ/mol
Flash Point: 183.4±22.2 °C
Index of Refraction: 1.484
Molar Refractivity: 178.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 2
ACD/LogP: 13.69
ACD/LogD (pH 5.5): 12.20
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.20
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 625.0±3.0 cm3

Click to predict properties on the Chemicalize site


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