ChemSpider 2D Image | 3-Amino-1-(4-bromophenyl)-9,10-dihydro-2,4-phenanthrenedicarbonitrile | C22H14BrN3

3-Amino-1-(4-bromophenyl)-9,10-dihydro-2,4-phenanthrenedicarbonitrile

  • Molecular FormulaC22H14BrN3
  • Average mass400.271 Da
  • Monoisotopic mass399.037109 Da
  • ChemSpider ID30657014

More details:

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

2,4-Phenanthrenedicarbonitrile, 3-amino-1-(4-bromophenyl)-9,10-dihydro- [ACD/Index Name]
3-Amino-1-(4-bromophenyl)-9,10-dihydro-2,4-phenanthrenedicarbonitrile [ACD/IUPAC Name]
3-Amino-1-(4-bromophényl)-9,10-dihydro-2,4-phénanthrènedicarbonitrile [French] [ACD/IUPAC Name]
3-Amino-1-(4-bromphenyl)-9,10-dihydro-2,4-phenanthrendicarbonitril [German] [ACD/IUPAC 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: 608.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 321.5±31.5 °C
Index of Refraction: 1.740
Molar Refractivity: 103.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 5.67
ACD/BCF (pH 5.5): 12011.41
ACD/KOC (pH 5.5): 28957.56
ACD/LogD (pH 7.4): 5.67
ACD/BCF (pH 7.4): 12011.41
ACD/KOC (pH 7.4): 28957.56
Polar Surface Area: 74 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 80.2±5.0 dyne/cm
Molar Volume: 257.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement