ChemSpider 2D Image | (11E,13E,15S)-15-Hydroxy(11,12,14,15-~2~H_4_)-11,13-icosadienoic acid | C20H32D4O3

(11E,13E,15S)-15-Hydroxy(11,12,14,15-2H4)-11,13-icosadienoic acid

  • Molecular FormulaC20H32D4O3
  • Average mass328.523 Da
  • Monoisotopic mass328.291565 Da
  • ChemSpider ID114815547

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(11E,13E,15S)-15-Hydroxy(11,12,14,15-2H4)-11,13-icosadienoic acid [ACD/IUPAC Name]
(11E,13E,15S)-15-Hydroxy(11,12,14,15-2H4)-11,13-icosadiensäure [German] [ACD/IUPAC Name]
11,13-Eicosadienoic-11,12,14,15-d4 acid, 15-hydroxy-, (11E,13E,15S)- [ACD/Index Name]
Acide (11E,13E,15S)-15-hydroxy(11,12,14,15-2H4)-11,13-icosadiénoïque [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 475.0±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.1±6.0 kJ/mol
Flash Point: 255.2±17.7 °C
Index of Refraction: 1.490
Molar Refractivity: 97.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 4015.04
ACD/KOC (pH 5.5): 7847.59
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 64.40
ACD/KOC (pH 7.4): 125.88
Polar Surface Area: 58 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 338.4±3.0 cm3

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