ChemSpider 2D Image | 3,6-Bis(11-hydroxyundecyl)-1,2-benzenediol | C28H50O4

3,6-Bis(11-hydroxyundecyl)-1,2-benzenediol

  • Molecular FormulaC28H50O4
  • Average mass450.694 Da
  • Monoisotopic mass450.370911 Da
  • ChemSpider ID57545537

More details:

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

1,4-Benzenediundecanol, 2,3-dihydroxy- [ACD/Index Name]
3,6-Bis(11-hydroxyundecyl)-1,2-benzenediol [ACD/IUPAC Name]
3,6-Bis(11-hydroxyundécyl)-1,2-benzènediol [French] [ACD/IUPAC Name]
3,6-Bis(11-hydroxyundecyl)-1,2-benzoldiol [German] [ACD/IUPAC Name]
3,6-Bis(11-hydroxyundecyl)benzene-1,2-diol
62422-71-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 602.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 247.1±24.7 °C
Index of Refraction: 1.523
Molar Refractivity: 135.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 8.42
ACD/LogD (pH 5.5): 7.07
ACD/BCF (pH 5.5): 138864.42
ACD/KOC (pH 5.5): 166970.06
ACD/LogD (pH 7.4): 7.07
ACD/BCF (pH 7.4): 138400.64
ACD/KOC (pH 7.4): 166412.41
Polar Surface Area: 81 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 444.1±3.0 cm3

Click to predict properties on the Chemicalize site


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