ChemSpider 2D Image | 5-Fluoro-N-[2-(4-fluorophenyl)ethyl]-6-methyl-4-pyrimidinamine | C13H13F2N3

5-Fluoro-N-[2-(4-fluorophenyl)ethyl]-6-methyl-4-pyrimidinamine

  • Molecular FormulaC13H13F2N3
  • Average mass249.259 Da
  • Monoisotopic mass249.107758 Da
  • ChemSpider ID49694339

More details:

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

4-Pyrimidinamine, 5-fluoro-N-[2-(4-fluorophenyl)ethyl]-6-methyl- [ACD/Index Name]
5-Fluor-N-[2-(4-fluorphenyl)ethyl]-6-methyl-4-pyrimidinamin [German] [ACD/IUPAC Name]
5-Fluoro-N-[2-(4-fluorophenyl)ethyl]-6-methyl-4-pyrimidinamine [ACD/IUPAC Name]
5-Fluoro-N-[2-(4-fluorophényl)éthyl]-6-méthyl-4-pyrimidinamine [French] [ACD/IUPAC Name]
1916285-86-3 [RN]
5-fluoro-N-[2-(4-fluorophenyl)ethyl]-6-methylpyrimidin-4-amine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 399.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.2±27.9 °C
Index of Refraction: 1.584
Molar Refractivity: 66.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 199.56
ACD/KOC (pH 5.5): 1521.49
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 208.90
ACD/KOC (pH 7.4): 1592.75
Polar Surface Area: 38 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 197.2±3.0 cm3

Click to predict properties on the Chemicalize site


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