ChemSpider 2D Image | 9,12,13-Trihydroxy-10-octadecenoic acid | C18H34O5

9,12,13-Trihydroxy-10-octadecenoic acid

  • Molecular FormulaC18H34O5
  • Average mass330.460 Da
  • Monoisotopic mass330.240631 Da
  • ChemSpider ID23350722

More details:

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

10-Octadecenoic acid, 9,12,13-trihydroxy- [ACD/Index Name]
9,12,13-Trihydroxy-10-octadecenoic acid [ACD/IUPAC Name]
9,12,13-Trihydroxy-10-octadecensäure [German] [ACD/IUPAC Name]
9,12,13-Trihydroxyoctadec-10-enoic acid
Acide 9,12,13-trihydroxy-10-octadécénoïque [French] [ACD/IUPAC Name]
29907-56-0 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 531.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.8±6.0 kJ/mol
Flash Point: 289.3±26.6 °C
Index of Refraction: 1.507
Molar Refractivity: 91.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 12.27
ACD/KOC (pH 5.5): 124.16
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.99
Polar Surface Area: 98 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 307.5±3.0 cm3

Click to predict properties on the Chemicalize site


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