ChemSpider 2D Image | 3-Bromo-5-nitro-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-4(1H)-pyridinone | C12H15BrN2O5

3-Bromo-5-nitro-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-4(1H)-pyridinone

  • Molecular FormulaC12H15BrN2O5
  • Average mass347.162 Da
  • Monoisotopic mass346.016418 Da
  • ChemSpider ID35203379

More details:

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

3-Brom-5-nitro-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-4(1H)-pyridinon [German] [ACD/IUPAC Name]
3-Bromo-5-nitro-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-4(1H)-pyridinone [ACD/IUPAC Name]
3-Bromo-5-nitro-1-[2-(tétrahydro-2H-pyran-2-yloxy)éthyl]-4(1H)-pyridinone [French] [ACD/IUPAC Name]
4(1H)-Pyridinone, 3-bromo-5-nitro-1-[2-[(tetrahydro-2H-pyran-2-yl)oxy]ethyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 434.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.5±28.7 °C
Index of Refraction: 1.596
Molar Refractivity: 74.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.58
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.57
ACD/KOC (pH 5.5): 47.97
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.57
ACD/KOC (pH 7.4): 47.97
Polar Surface Area: 85 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 58.2±5.0 dyne/cm
Molar Volume: 217.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement