ChemSpider 2D Image | 2-(4-Fluorophenyl)-N-phenyl-4,6-pyrimidinediamine | C16H13FN4

2-(4-Fluorophenyl)-N-phenyl-4,6-pyrimidinediamine

  • Molecular FormulaC16H13FN4
  • Average mass280.300 Da
  • Monoisotopic mass280.112427 Da
  • ChemSpider ID27454841

More details:

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

2-(4-Fluorophenyl)-N-phenyl-4,6-pyrimidinediamine [ACD/IUPAC Name]
2-(4-Fluorophényl)-N-phényl-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]
2-(4-Fluorphenyl)-N-phenyl-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
4,6-Pyrimidinediamine, 2-(4-fluorophenyl)-N4-phenyl- [ACD/Index Name]
2-(4-fluorophenyl)-N-phenylpyrimidine-4,6-diamine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 391.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 190.3±27.9 °C
Index of Refraction: 1.679
Molar Refractivity: 80.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 45.22
ACD/KOC (pH 5.5): 354.21
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 182.62
ACD/KOC (pH 7.4): 1430.52
Polar Surface Area: 64 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 213.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement