ChemSpider 2D Image | 3-[3,5-Bis(trifluoromethyl)phenyl]-N-(2-oxo-3-azepanyl)acrylamide | C17H16F6N2O2

3-[3,5-Bis(trifluoromethyl)phenyl]-N-(2-oxo-3-azepanyl)acrylamide

  • Molecular FormulaC17H16F6N2O2
  • Average mass394.312 Da
  • Monoisotopic mass394.111603 Da
  • ChemSpider ID35325013

More details:

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

2-Propenamide, 3-[3,5-bis(trifluoromethyl)phenyl]-N-(hexahydro-2-oxo-1H-azepin-3-yl)- [ACD/Index Name]
3-[3,5-Bis(trifluormethyl)phenyl]-N-(2-oxo-3-azepanyl)acrylamid [German] [ACD/IUPAC Name]
3-[3,5-Bis(trifluoromethyl)phenyl]-N-(2-oxo-3-azepanyl)acrylamide [ACD/IUPAC Name]
3-[3,5-Bis(trifluorométhyl)phényl]-N-(2-oxo-3-azépanyl)acrylamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 535.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.5±30.1 °C
Index of Refraction: 1.500
Molar Refractivity: 83.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 44.10
ACD/KOC (pH 5.5): 523.23
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 44.10
ACD/KOC (pH 7.4): 523.23
Polar Surface Area: 58 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 38.9±5.0 dyne/cm
Molar Volume: 284.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement