ChemSpider 2D Image | 1-LAURIN-2-OLEIN-3-PALMITIN | C49H92O6

1-LAURIN-2-OLEIN-3-PALMITIN

  • Molecular FormulaC49H92O6
  • Average mass777.251 Da
  • Monoisotopic mass776.689392 Da
  • ChemSpider ID17346874

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z)-9-Octadécénoate de 1-(dodecanoyloxy)-3-(palmitoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
1-(Dodecanoyloxy)-3-(palmitoyloxy)-2-propanyl (9Z)-9-octadecenoate [ACD/IUPAC Name]
1-(Dodecanoyloxy)-3-(palmitoyloxy)-2-propanyl-(9Z)-9-octadecenoat [German] [ACD/IUPAC Name]
1-LAURIN-2-OLEIN-3-PALMITIN
51604-51-4 [RN]
9-Octadecenoic acid, 2-[(1-oxododecyl)oxy]-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9Z)- [ACD/Index Name]
(1-Dodecanoyloxy-3-hexadecanoyloxypropan-2-yl) (Z)-octadec-9-enoate
(Z)-1-(Dodecanoyloxy)-3-(palmitoyloxy)propan-2-yl oleate
[51604-51-4] [RN]
1-(DODECANOYLOXY)-3-(HEXADECANOYLOXY)PROPAN-2-YL (9Z)-OCTADEC-9-ENOATE
More...

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

L0775_SIGMA [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 746.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 283.6±24.6 °C
Index of Refraction: 1.469
Molar Refractivity: 234.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 47
#Rule of 5 Violations: 2
ACD/LogP: 20.50
ACD/LogD (pH 5.5): 19.61
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 19.61
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 92.9±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 841.8±3.0 cm3

Click to predict properties on the Chemicalize site


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