ChemSpider 2D Image | (5S,6E,8E,10E,12R,14E)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid | C20H32O5

(5S,6E,8E,10E,12R,14E)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid

  • Molecular FormulaC20H32O5
  • Average mass352.465 Da
  • Monoisotopic mass352.224976 Da
  • ChemSpider ID107562517

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5S,6E,8E,10E,12R,14E)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid [ACD/IUPAC Name]
(5S,6E,8E,10E,12R,14E)-5,12,20-Trihydroxy-6,8,10,14-icosatetraensäure [German] [ACD/IUPAC Name]
6,8,10,14-Eicosatetraenoic acid, 5,12,20-trihydroxy-, (5S,6E,8E,10E,12R,14E)- [ACD/Index Name]
Acide (5S,6E,8E,10E,12R,14E)-5,12,20-trihydroxy-6,8,10,14-icosatétraénoïque [French] [ACD/IUPAC Name]
20-Hydroxyleukotriene B4

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

Density: 1.1±0.1 g/cm3
Boiling Point: 581.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.9±6.0 kJ/mol
Flash Point: 319.7±26.6 °C
Index of Refraction: 1.542
Molar Refractivity: 101.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 32.50
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 321.0±3.0 cm3

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