ChemSpider 2D Image | Ethyl (2E,4E,6E,8E,10E,12E)-2,4,6,8,10,12-docosahexaenoate | C24H36O2

Ethyl (2E,4E,6E,8E,10E,12E)-2,4,6,8,10,12-docosahexaenoate

  • Molecular FormulaC24H36O2
  • Average mass356.541 Da
  • Monoisotopic mass356.271515 Da
  • ChemSpider ID95671536

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E,6E,8E,10E,12E)-2,4,6,8,10,12-Docosahexaénoate d'éthyle [French] [ACD/IUPAC Name]
2,4,6,8,10,12-Docosahexaenoic acid, ethyl ester, (2E,4E,6E,8E,10E,12E)- [ACD/Index Name]
Ethyl (2E,4E,6E,8E,10E,12E)-2,4,6,8,10,12-docosahexaenoate [ACD/IUPAC Name]
Ethyl-(2E,4E,6E,8E,10E,12E)-2,4,6,8,10,12-docosahexaenoat [German] [ACD/IUPAC Name]
1020718-25-5 [RN]
Ethyl docosa-2,4,6,8,10,12-hexaenoate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 481.2±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 263.6±11.2 °C
Index of Refraction: 1.504
Molar Refractivity: 115.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.82
ACD/LogD (pH 5.5): 8.16
ACD/BCF (pH 5.5): 936548.88
ACD/KOC (pH 5.5): 654621.06
ACD/LogD (pH 7.4): 8.16
ACD/BCF (pH 7.4): 936548.88
ACD/KOC (pH 7.4): 654621.06
Polar Surface Area: 26 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 389.9±3.0 cm3

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