ChemSpider 2D Image | 13-Hydroxy-13-(3-pentyl-2-oxiranyl)-5,8,11-tridecatrienoic acid | C20H32O4

13-Hydroxy-13-(3-pentyl-2-oxiranyl)-5,8,11-tridecatrienoic acid

  • Molecular FormulaC20H32O4
  • Average mass336.466 Da
  • Monoisotopic mass336.230072 Da
  • ChemSpider ID23353172

More details:

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

13-Hydroxy-13-(3-pentyl-2-oxiranyl)-5,8,11-tridecatrienoic acid [ACD/IUPAC Name]
13-Hydroxy-13-(3-pentyl-2-oxiranyl)-5,8,11-tridecatriensäure [German] [ACD/IUPAC Name]
5,8,11-Tridecatrienoic acid, 13-hydroxy-13-(3-pentyloxiranyl)- [ACD/Index Name]
Acide 13-hydroxy-13-(3-pentyl-2-oxiranyl)-5,8,11-tridécatriénoïque [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: 503.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.9±6.0 kJ/mol
Flash Point: 170.7±23.6 °C
Index of Refraction: 1.519
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 597.04
ACD/KOC (pH 5.5): 2005.04
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 9.58
ACD/KOC (pH 7.4): 32.16
Polar Surface Area: 70 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 321.5±3.0 cm3

Click to predict properties on the Chemicalize site


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