Found 30 results

Search term: MF = 'C_{63}H_{120}O_{5}'
ChemSpider 2D Image | 3-[(11Z)-11-Icosenoyloxy]-2-(octadecyloxy)propyl (13Z)-13-docosenoate | C63H120O5

3-[(11Z)-11-Icosenoyloxy]-2-(octadecyloxy)propyl (13Z)-13-docosenoate

  • Molecular FormulaC63H120O5
  • Average mass957.624 Da
  • Monoisotopic mass956.913574 Da
  • ChemSpider ID59658809

  • 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

(13Z)-13-Docosénoate de 3-[(11Z)-11-icosenoyloxy]-2-(octadécyloxy)propyle [French] [ACD/IUPAC Name]
13-Docosenoic acid, 2-(octadecyloxy)-3-[[(11Z)-1-oxo-11-eicosen-1-yl]oxy]propyl ester, (13Z)- [ACD/Index Name]
3-[(11Z)-11-Icosenoyloxy]-2-(octadecyloxy)propyl (13Z)-13-docosenoate [ACD/IUPAC Name]
3-[(11Z)-11-Icosenoyloxy]-2-(octadecyloxy)propyl-(13Z)-13-docosenoat [German] [ACD/IUPAC Name]
(2R)-3-[(11Z)-icos-11-enoyloxy]-2-(octadecyloxy)propyl (13Z)-docos-13-enoate
1-(11-Eicosenoyl)-2-octadecanyl-3-(13Z-docosenoyl)-glycerol
1-Eicosenoyl-2-Stearyl-3-erucoyl-glycerol
TAG(20:1/18:0/22:1)
TAG(60:2)
TG(20:1(11Z)/o-18:0/22:1(13Z))
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: 870.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 126.5±3.0 kJ/mol
Flash Point: 314.7±28.8 °C
Index of Refraction: 1.472
Molar Refractivity: 299.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 60
#Rule of 5 Violations: 2
ACD/LogP: 28.15
ACD/LogD (pH 5.5): 25.83
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 25.83
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 62 Å2
Polarizability: 118.6±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 1069.4±3.0 cm3

Click to predict properties on the Chemicalize site


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