ChemSpider 2D Image | 4-(4-Bromophenyl)-2-oxo-1,2,5,6-tetrahydrobenzo[h]quinoline-3-carbonitrile | C20H13BrN2O

4-(4-Bromophenyl)-2-oxo-1,2,5,6-tetrahydrobenzo[h]quinoline-3-carbonitrile

  • Molecular FormulaC20H13BrN2O
  • Average mass377.234 Da
  • Monoisotopic mass376.021118 Da
  • ChemSpider ID30656983

More details:

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

4-(4-Bromophényl)-2-oxo-1,2,5,6-tétrahydrobenzo[h]quinoléine-3-carbonitrile [French] [ACD/IUPAC Name]
4-(4-Bromophenyl)-2-oxo-1,2,5,6-tetrahydrobenzo[h]quinoline-3-carbonitrile [ACD/IUPAC Name]
4-(4-Bromphenyl)-2-oxo-1,2,5,6-tetrahydrobenzo[h]chinolin-3-carbonitril [German] [ACD/IUPAC Name]
Benzo[h]quinoline-3-carbonitrile, 4-(4-bromophenyl)-1,2,5,6-tetrahydro-2-oxo- [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: 629.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.7±31.5 °C
Index of Refraction: 1.719
Molar Refractivity: 94.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 4.85
ACD/BCF (pH 5.5): 2870.06
ACD/KOC (pH 5.5): 10393.07
ACD/LogD (pH 7.4): 4.85
ACD/BCF (pH 7.4): 2851.35
ACD/KOC (pH 7.4): 10325.30
Polar Surface Area: 53 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 68.7±5.0 dyne/cm
Molar Volume: 240.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement