ChemSpider 2D Image | 3-(4-Methoxyphenoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one | C26H27F3N2O6

3-(4-Methoxyphenoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one

  • Molecular FormulaC26H27F3N2O6
  • Average mass520.498 Da
  • Monoisotopic mass520.182129 Da
  • ChemSpider ID24570613

More details:

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

3-(4-Methoxyphenoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluormethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-on [German] [ACD/IUPAC Name]
3-(4-Methoxyphenoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one [ACD/IUPAC Name]
3-(4-Méthoxyphénoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluorométhyl)-9,10-dihydro-4H,8H-chroméno[8,7-e][1,3]oxazin-4-one [French] [ACD/IUPAC Name]
3-(4-Methoxyphenoxy)-9-[3-(morpholin-4-yl)propyl]-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
4H,8H-Pyrano[2,3-f][1,3]benzoxazin-4-one, 9,10-dihydro-3-(4-methoxyphenoxy)-9-[3-(4-morpholinyl)propyl]-2-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 589.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.3±30.1 °C
Index of Refraction: 1.563
Molar Refractivity: 125.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.42
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 2.79
ACD/KOC (pH 5.5): 18.49
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 127.70
ACD/KOC (pH 7.4): 847.11
Polar Surface Area: 70 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 387.2±3.0 cm3

Click to predict properties on the Chemicalize site


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