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

3-(3,4-Dimethoxyphenyl)-9-[2-(4-morpholinyl)ethyl]-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 ID24570276

More details:

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

3-(3,4-Dimethoxyphenyl)-9-[2-(4-morpholinyl)ethyl]-2-(trifluormethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-on [German] [ACD/IUPAC Name]
3-(3,4-Dimethoxyphenyl)-9-[2-(4-morpholinyl)ethyl]-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one [ACD/IUPAC Name]
3-(3,4-Diméthoxyphényl)-9-[2-(4-morpholinyl)éthyl]-2-(trifluorométhyl)-9,10-dihydro-4H,8H-chroméno[8,7-e][1,3]oxazin-4-one [French] [ACD/IUPAC Name]
3-(3,4-Dimethoxyphenyl)-9-[2-(morpholin-4-yl)ethyl]-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, 3-(3,4-dimethoxyphenyl)-9,10-dihydro-9-[2-(4-morpholinyl)ethyl]-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: 585.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.7±30.1 °C
Index of Refraction: 1.561
Molar Refractivity: 126.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 10.34
ACD/KOC (pH 5.5): 65.13
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 272.88
ACD/KOC (pH 7.4): 1718.45
Polar Surface Area: 70 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 389.4±3.0 cm3

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