ChemSpider 2D Image | 3,3,3-Trifluoro-N-(3-fluoro-4-methoxybenzyl)-1-propanamine | C11H13F4NO

3,3,3-Trifluoro-N-(3-fluoro-4-methoxybenzyl)-1-propanamine

  • Molecular FormulaC11H13F4NO
  • Average mass251.221 Da
  • Monoisotopic mass251.093323 Da
  • ChemSpider ID40323167

More details:

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

3,3,3-Trifluor-N-(3-fluor-4-methoxybenzyl)-1-propanamin [German] [ACD/IUPAC Name]
3,3,3-Trifluoro-N-(3-fluoro-4-methoxybenzyl)-1-propanamine [ACD/IUPAC Name]
3,3,3-Trifluoro-N-(3-fluoro-4-méthoxybenzyl)-1-propanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, 3-fluoro-4-methoxy-N-(3,3,3-trifluoropropyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 254.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 108.0±27.3 °C
Index of Refraction: 1.447
Molar Refractivity: 55.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.98
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 13.54
ACD/KOC (pH 7.4): 150.72
Polar Surface Area: 21 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 27.7±3.0 dyne/cm
Molar Volume: 208.7±3.0 cm3

Click to predict properties on the Chemicalize site


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