ChemSpider 2D Image | 5-Hydroxy-6-sulfanyl-7,9,11,14-icosatetraenoic acid | C20H32O3S

5-Hydroxy-6-sulfanyl-7,9,11,14-icosatetraenoic acid

  • Molecular FormulaC20H32O3S
  • Average mass352.531 Da
  • Monoisotopic mass352.207214 Da
  • ChemSpider ID23349460

More details:

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

5-Hydroxy-6-sulfanyl-7,9,11,14-icosatetraenoic acid [ACD/IUPAC Name]
5-Hydroxy-6-sulfanyl-7,9,11,14-icosatetraensäure [German] [ACD/IUPAC Name]
5-Hydroxy-6-sulfanylicosa-7,9,11,14-tetraenoic acid
7,9,11,14-Eicosatetraenoic acid, 5-hydroxy-6-mercapto- [ACD/Index Name]
Acide 5-hydroxy-6-sulfanyl-7,9,11,14-icosatétraénoïque [French] [ACD/IUPAC Name]
125467-37-0 [RN]
5-hydroxy-6-mercapto-7,9,11,14-eicosatetraenoic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 539.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 93.9±6.0 kJ/mol
Flash Point: 279.9±30.1 °C
Index of Refraction: 1.535
Molar Refractivity: 105.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 5.83
ACD/LogD (pH 5.5): 4.66
ACD/BCF (pH 5.5): 1251.20
ACD/KOC (pH 5.5): 3181.67
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 19.62
ACD/KOC (pH 7.4): 49.90
Polar Surface Area: 96 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 340.1±3.0 cm3

Click to predict properties on the Chemicalize site


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