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Search term: 23255769 (Found by CSID)

ChemSpider 2D Image | MFCD00214266 | C53H98O6

MFCD00214266

  • Molecular FormulaC53H98O6
  • Average mass831.342 Da
  • Monoisotopic mass830.736328 Da
  • ChemSpider ID23255769
  • Double-bond stereo - Double-bond stereo


More details:






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

(9Z,12Z)-9,12-Octadécadiénoate de 1,3-bis(palmitoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
1,3-bis(hexadecanoyloxy)propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
1,3-Bis(palmitoyloxy)-2-propanyl (9Z,12Z)-9,12-octadecadienoate [ACD/IUPAC Name]
1,3-Bis(palmitoyloxy)-2-propanyl-(9Z,12Z)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
1,3-Dipalmito-2-linolein
1,3-Dipalmitoyl-2-Linoleoyl Glycerol
1,3-Dipalmitoyl-2-linoleoylglycerol
2442-56-0 [RN]
2-Linoleoyl-1,3-dipalmitin
2-Linoleoyl-1,3-dipalmitoylglycerol
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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: 784.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 293.9±27.4 °C
Index of Refraction: 1.473
Molar Refractivity: 253.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 50
#Rule of 5 Violations: 2
ACD/LogP: 22.10
ACD/LogD (pH 5.5): 20.76
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 20.76
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: 34.6±3.0 dyne/cm
Molar Volume: 901.4±3.0 cm3

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