ChemSpider 2D Image | 4,6-Bis(4-chlorophenyl)-N-{3-[2-(diethylamino)ethoxy]phenyl}-2-pyrimidinamine | C28H28Cl2N4O

4,6-Bis(4-chlorophenyl)-N-{3-[2-(diethylamino)ethoxy]phenyl}-2-pyrimidinamine

  • Molecular FormulaC28H28Cl2N4O
  • Average mass507.454 Da
  • Monoisotopic mass506.164032 Da
  • ChemSpider ID28663114

More details:






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

2-Pyrimidinamine, 4,6-bis(4-chlorophenyl)-N-[3-[2-(diethylamino)ethoxy]phenyl]- [ACD/Index Name]
4,6-Bis(4-chlorophenyl)-N-{3-[2-(diethylamino)ethoxy]phenyl}-2-pyrimidinamine [ACD/IUPAC Name]
4,6-Bis(4-chlorophényl)-N-{3-[2-(diéthylamino)éthoxy]phényl}-2-pyrimidinamine [French] [ACD/IUPAC Name]
4,6-Bis(4-chlorphenyl)-N-{3-[2-(diethylamino)ethoxy]phenyl}-2-pyrimidinamin [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 662.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.4±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 144.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.04
ACD/LogD (pH 5.5): 3.85
ACD/BCF (pH 5.5): 91.83
ACD/KOC (pH 5.5): 119.47
ACD/LogD (pH 7.4): 4.75
ACD/BCF (pH 7.4): 733.24
ACD/KOC (pH 7.4): 953.90
Polar Surface Area: 50 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 410.2±3.0 cm3

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