ChemSpider 2D Image | 2-({[(E)-{1-[3-(Trifluoromethyl)phenyl]ethylidene}amino]oxy}methyl)benzonitrile | C17H13F3N2O

2-({[(E)-{1-[3-(Trifluoromethyl)phenyl]ethylidene}amino]oxy}methyl)benzonitrile

  • Molecular FormulaC17H13F3N2O
  • Average mass318.293 Da
  • Monoisotopic mass318.097992 Da
  • ChemSpider ID71047207

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({[(E)-{1-[3-(Trifluormethyl)phenyl]ethyliden}amino]oxy}methyl)benzonitril [German] [ACD/IUPAC Name]
2-({[(E)-{1-[3-(Trifluoromethyl)phenyl]ethylidene}amino]oxy}methyl)benzonitrile [ACD/IUPAC Name]
2-({[(E)-{1-[3-(Trifluorométhyl)phényl]éthylidène}amino]oxy}méthyl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-[[[[(1E)-1-[3-(trifluoromethyl)phenyl]ethylidene]amino]oxy]methyl]- [ACD/Index Name]
CGA 357276

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

Density: 1.2±0.1 g/cm3
Boiling Point: 404.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 198.7±31.5 °C
Index of Refraction: 1.519
Molar Refractivity: 82.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 700.32
ACD/KOC (pH 5.5): 3786.75
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 700.32
ACD/KOC (pH 7.4): 3786.75
Polar Surface Area: 45 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 34.4±7.0 dyne/cm
Molar Volume: 270.4±7.0 cm3

Click to predict properties on the Chemicalize site


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