ChemSpider 2D Image | 3-{(4-Fluorobenzyl)[2-(2-pyridinyl)ethyl]amino}propanenitrile | C17H18FN3

3-{(4-Fluorobenzyl)[2-(2-pyridinyl)ethyl]amino}propanenitrile

  • Molecular FormulaC17H18FN3
  • Average mass283.343 Da
  • Monoisotopic mass283.148468 Da
  • ChemSpider ID30168183

More details:

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

3-{(4-Fluorbenzyl)[2-(2-pyridinyl)ethyl]amino}propannitril [German] [ACD/IUPAC Name]
3-{(4-Fluorobenzyl)[2-(2-pyridinyl)ethyl]amino}propanenitrile [ACD/IUPAC Name]
3-{(4-Fluorobenzyl)[2-(2-pyridinyl)éthyl]amino}propanenitrile [French] [ACD/IUPAC Name]
Propanenitrile, 3-[[(4-fluorophenyl)methyl][2-(2-pyridinyl)ethyl]amino]- [ACD/Index Name]
3-{[(4-FLUOROPHENYL)METHYL][2-(PYRIDIN-2-YL)ETHYL]AMINO}PROPANENITRILE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 447.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 224.1±27.3 °C
Index of Refraction: 1.566
Molar Refractivity: 80.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 4.22
ACD/KOC (pH 5.5): 47.31
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 46.80
ACD/KOC (pH 7.4): 525.26
Polar Surface Area: 40 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 247.0±3.0 cm3

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