ChemSpider 2D Image | (6E,8Z,11Z,14Z,16E)-5-Hydroperoxy-18-hydroxy-6,8,11,14,16-icosapentaenoic acid | C20H30O5

(6E,8Z,11Z,14Z,16E)-5-Hydroperoxy-18-hydroxy-6,8,11,14,16-icosapentaenoic acid

  • Molecular FormulaC20H30O5
  • Average mass350.449 Da
  • Monoisotopic mass350.209320 Da
  • ChemSpider ID129307347

  • Double-bond stereo - Double-bond stereo

More details:

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

(6E,8Z,11Z,14Z,16E)-5-Hydroperoxy-18-hydroxy-6,8,11,14,16-icosapentaenoic acid [ACD/IUPAC Name]
(6E,8Z,11Z,14Z,16E)-5-Hydroperoxy-18-hydroxy-6,8,11,14,16-icosapentaensäure [German] [ACD/IUPAC Name]
6,8,11,14,16-Eicosapentaenoic acid, 5-hydroperoxy-18-hydroxy-, (6E,8Z,11Z,14Z,16E)- [ACD/Index Name]
Acide (6E,8Z,11Z,14Z,16E)-5-hydroperoxy-18-hydroxy-6,8,11,14,16-icosapentaénoïque [French] [ACD/IUPAC Name]
5S-Hydroperoxy-18R-HEPE
5S-Hydroperoxy-18R-hydroxy-6E,8Z,11Z,14Z,16E-eicosapentaenoic acid
C18176

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

Density: 1.1±0.1 g/cm3
Boiling Point: 570.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.2±6.0 kJ/mol
Flash Point: 196.5±23.6 °C
Index of Refraction: 1.539
Molar Refractivity: 101.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 35.20
ACD/KOC (pH 5.5): 244.43
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.85
Polar Surface Area: 87 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 323.5±3.0 cm3

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