ChemSpider 2D Image | (6E,8Z,11Z,14Z)-5-Hydroperoxy-6,8,11,14-icosatetraenoate | C20H31O4

(6E,8Z,11Z,14Z)-5-Hydroperoxy-6,8,11,14-icosatetraenoate

  • Molecular FormulaC20H31O4
  • Average mass335.458 Da
  • Monoisotopic mass335.222778 Da
  • ChemSpider ID58164099

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

(6E,8Z,11Z,14Z)-5-Hydroperoxy-6,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
(6E,8Z,11Z,14Z)-5-Hydroperoxy-6,8,11,14-icosatetraenoate [ACD/IUPAC Name]
(6E,8Z,11Z,14Z)-5-Hydroperoxy-6,8,11,14-icosatétraénoate [French] [ACD/IUPAC Name]
6,8,11,14-Eicosatetraenoic acid, 5-hydroperoxy-, ion(1-), (6E,8Z,11Z,14Z)- [ACD/Index Name]
(6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoate
(6E,8Z,11Z,14Z)-5-hydroperoxyicosatetraenoate
5-HPETE(1-)
5-hydroperoxy-(6E,8Z,11Z,14Z)-eicosatetraenoate
5-hydroperoxy-(6E,8Z,11Z,14Z)-icosatetraenoate
  • Miscellaneous

    • Chemical Class:

      A HPETE anion that is the conjugate base of 5-HPETE arising from deprotonation of the carboxylic acid function; major species at pH 7.3. ChEBI CHEBI:90822

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

Density:
Boiling Point: 518.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.0±6.0 kJ/mol
Flash Point: 175.6±23.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 6.38
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 2133.11
ACD/KOC (pH 5.5): 4614.06
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 33.58
ACD/KOC (pH 7.4): 72.64
Polar Surface Area: 70 Å2
Polarizability:
Surface Tension:
Molar Volume:

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