ChemSpider 2D Image | N-(8,10-Dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)-3,5-bis(trifluoromethyl)benzamide | C24H16F6N2O3

N-(8,10-Dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)-3,5-bis(trifluoromethyl)benzamide

  • Molecular FormulaC24H16F6N2O3
  • Average mass494.386 Da
  • Monoisotopic mass494.106506 Da
  • ChemSpider ID39269242

More details:

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

Benzamide, N-(10,11-dihydro-8,10-dimethyl-11-oxodibenz[b,f][1,4]oxazepin-2-yl)-3,5-bis(trifluoromethyl)- [ACD/Index Name]
N-(8,10-Dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)-3,5-bis(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-(8,10-Dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)-3,5-bis(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-(8,10-Diméthyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazépin-2-yl)-3,5-bis(trifluorométhyl)benzamide [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: 501.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 257.0±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 113.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 5.29
ACD/BCF (pH 5.5): 6174.46
ACD/KOC (pH 5.5): 17984.67
ACD/LogD (pH 7.4): 5.29
ACD/BCF (pH 7.4): 6174.20
ACD/KOC (pH 7.4): 17983.89
Polar Surface Area: 59 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 344.6±3.0 cm3

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