ChemSpider 2D Image | 2-Isopropoxy-N-[4-(trifluoromethoxy)phenyl]-N'-{1-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl}-4,6-pyrimidinediamine | C24H20F6N6O2

2-Isopropoxy-N-[4-(trifluoromethoxy)phenyl]-N'-{1-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl}-4,6-pyrimidinediamine

  • Molecular FormulaC24H20F6N6O2
  • Average mass538.445 Da
  • Monoisotopic mass538.155212 Da
  • ChemSpider ID25052623

More details:

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

2-Isopropoxy-N-[4-(trifluormethoxy)phenyl]-N'-{1-[3-(trifluormethyl)phenyl]-1H-imidazol-2-yl}-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
2-Isopropoxy-N-[4-(trifluoromethoxy)phenyl]-N'-{1-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl}-4,6-pyrimidinediamine [ACD/IUPAC Name]
2-Isopropoxy-N-[4-(trifluorométhoxy)phényl]-N'-{1-[3-(trifluorométhyl)phényl]-1H-imidazol-2-yl}-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]
4,6-Pyrimidinediamine, 2-(1-methylethoxy)-N4-[4-(trifluoromethoxy)phenyl]-N6-[1-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 603.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.8±3.0 kJ/mol
Flash Point: 319.0±34.3 °C
Index of Refraction: 1.575
Molar Refractivity: 124.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.54
ACD/LogD (pH 5.5): 6.54
ACD/BCF (pH 5.5): 51132.09
ACD/KOC (pH 5.5): 75208.67
ACD/LogD (pH 7.4): 6.66
ACD/BCF (pH 7.4): 68047.00
ACD/KOC (pH 7.4): 100088.31
Polar Surface Area: 86 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 39.7±7.0 dyne/cm
Molar Volume: 378.0±7.0 cm3

Click to predict properties on the Chemicalize site


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