Found 219 results

Search term: MF = 'C_{59}H_{110}O_{6}'
ChemSpider 2D Image | 2-(Icosanoyloxy)-3-[(9Z)-9-tetradecenoyloxy]propyl (13Z)-13-docosenoate | C59H110O6

2-(Icosanoyloxy)-3-[(9Z)-9-tetradecenoyloxy]propyl (13Z)-13-docosenoate

  • Molecular FormulaC59H110O6
  • Average mass915.501 Da
  • Monoisotopic mass914.830261 Da
  • ChemSpider ID59656988

  • 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 2-(icosanoyloxy)-3-[(9Z)-9-tetradecenoyloxy]propyle [French] [ACD/IUPAC Name]
13-Docosenoic acid, 2-[(1-oxoeicosyl)oxy]-3-[[(9Z)-1-oxo-9-tetradecen-1-yl]oxy]propyl ester, (13Z)- [ACD/Index Name]
2-(Icosanoyloxy)-3-[(9Z)-9-tetradecenoyloxy]propyl (13Z)-13-docosenoate [ACD/IUPAC Name]
2-(Icosanoyloxy)-3-[(9Z)-9-tetradecenoyloxy]propyl-(13Z)-13-docosenoat [German] [ACD/IUPAC Name]
(2R)-2-(icosanoyloxy)-3-[(9Z)-tetradec-9-enoyloxy]propyl (13Z)-docos-13-enoate
1-(9Z-Tetradecenoyl)-2-eicosanoyl-3-(13Z-docosenoyl)-glycerol
1-Myristoleoyl-2-arachidonyl-3-erucoyl-glycerol
TAG(14:1/20:0/22:1)
TAG(56:2)
TG(14:1(9Z)/20:0/22:1(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: 833.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.2±3.0 kJ/mol
Flash Point: 305.6±26.0 °C
Index of Refraction: 1.473
Molar Refractivity: 280.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 56
#Rule of 5 Violations: 2
ACD/LogP: 25.29
ACD/LogD (pH 5.5): 22.86
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 22.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 111.3±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 1000.5±3.0 cm3

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