ChemSpider 2D Image | 9-Oxooctacosanoic acid | C28H54O3

9-Oxooctacosanoic acid

  • Molecular FormulaC28H54O3
  • Average mass438.727 Da
  • Monoisotopic mass438.407288 Da
  • ChemSpider ID113368295

More details:

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

9-Oxooctacosanoic acid [ACD/IUPAC Name]
9-Oxooctacosansäure [German] [ACD/IUPAC Name]
Acide 9-oxooctacosanoïque [French] [ACD/IUPAC Name]
Octacosanoic acid, 9-oxo- [ACD/Index Name]
9-Ketooctacosanoic acid
9-oxo-Octacosanoic acid

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

Density: 0.9±0.1 g/cm3
Boiling Point: 564.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 92.7±6.0 kJ/mol
Flash Point: 309.1±21.9 °C
Index of Refraction: 1.465
Molar Refractivity: 133.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 1
ACD/LogP: 11.02
ACD/LogD (pH 5.5): 9.48
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1476019.75
ACD/LogD (pH 7.4): 7.68
ACD/BCF (pH 7.4): 97183.43
ACD/KOC (pH 7.4): 23652.37
Polar Surface Area: 54 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 482.5±3.0 cm3

Click to predict properties on the Chemicalize site


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