ChemSpider 2D Image | 3-(5-Bromo-2-furyl)-3-oxo-2-(2-quinolinyl)propanenitrile | C16H9BrN2O2

3-(5-Bromo-2-furyl)-3-oxo-2-(2-quinolinyl)propanenitrile

  • Molecular FormulaC16H9BrN2O2
  • Average mass341.159 Da
  • Monoisotopic mass339.984741 Da
  • ChemSpider ID29825461

More details:

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

2-Quinolineacetonitrile, α-[(5-bromo-2-furanyl)carbonyl]- [ACD/Index Name]
3-(5-Brom-2-furyl)-2-(2-chinolinyl)-3-oxopropannitril [German] [ACD/IUPAC Name]
3-(5-Bromo-2-furyl)-3-oxo-2-(2-quinoléinyl)propanenitrile [French] [ACD/IUPAC Name]
3-(5-Bromo-2-furyl)-3-oxo-2-(2-quinolinyl)propanenitrile [ACD/IUPAC Name]
3-(5-BROMOFURAN-2-YL)-3-OXO-2-(QUINOLIN-2-YL)PROPANENITRILE

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

Density: 1.6±0.1 g/cm3
Boiling Point: 510.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 262.4±30.1 °C
Index of Refraction: 1.666
Molar Refractivity: 81.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 67 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 62.1±3.0 dyne/cm
Molar Volume: 218.6±3.0 cm3

Click to predict properties on the Chemicalize site


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