ChemSpider 2D Image | 6-{3-[1-(4-Fluorobutyl)-1H-pyrazol-3-yl]phenyl}-N,N-dimethyl-4-pyrimidinamine | C19H22FN5

6-{3-[1-(4-Fluorobutyl)-1H-pyrazol-3-yl]phenyl}-N,N-dimethyl-4-pyrimidinamine

  • Molecular FormulaC19H22FN5
  • Average mass339.410 Da
  • Monoisotopic mass339.185913 Da
  • ChemSpider ID22415238

More details:

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

4-Pyrimidinamine, 6-[3-[1-(4-fluorobutyl)-1H-pyrazol-3-yl]phenyl]-N,N-dimethyl- [ACD/Index Name]
6-{3-[1-(4-Fluorbutyl)-1H-pyrazol-3-yl]phenyl}-N,N-dimethyl-4-pyrimidinamin [German] [ACD/IUPAC Name]
6-{3-[1-(4-Fluorobutyl)-1H-pyrazol-3-yl]phenyl}-N,N-dimethyl-4-pyrimidinamine [ACD/IUPAC Name]
6-{3-[1-(4-Fluorobutyl)-1H-pyrazol-3-yl]phényl}-N,N-diméthyl-4-pyrimidinamine [French] [ACD/IUPAC 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: 535.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.7±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 99.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 307.75
ACD/KOC (pH 5.5): 1877.24
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 455.41
ACD/KOC (pH 7.4): 2777.97
Polar Surface Area: 47 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 41.7±7.0 dyne/cm
Molar Volume: 289.7±7.0 cm3

Click to predict properties on the Chemicalize site


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