ChemSpider 2D Image | 3-[(2-Ethylhexyl)oxy]propanenitrile | C11H21NO

3-[(2-Ethylhexyl)oxy]propanenitrile

  • Molecular FormulaC11H21NO
  • Average mass183.290 Da
  • Monoisotopic mass183.162308 Da
  • ChemSpider ID21428035

More details:

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

3-[(2-Ethylhexyl)oxy]propanenitrile [ACD/IUPAC Name]
3-[(2-Éthylhexyl)oxy]propanenitrile [French] [ACD/IUPAC Name]
3-[(2-Ethylhexyl)oxy]propannitril [German] [ACD/IUPAC Name]
Propanenitrile, 3-[(2-ethylhexyl)oxy]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 282.1±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.1±3.0 kJ/mol
Flash Point: 118.5±13.7 °C
Index of Refraction: 1.433
Molar Refractivity: 54.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 162.91
ACD/KOC (pH 5.5): 1333.27
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 162.91
ACD/KOC (pH 7.4): 1333.27
Polar Surface Area: 33 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 210.2±3.0 cm3

Click to predict properties on the Chemicalize site


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