ChemSpider 2D Image | [2-(4-Bromophenyl)-4-morpholinyl]{4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanone | C21H17BrF3N3O2

[2-(4-Bromophenyl)-4-morpholinyl]{4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanone

  • Molecular FormulaC21H17BrF3N3O2
  • Average mass480.278 Da
  • Monoisotopic mass479.045624 Da
  • ChemSpider ID34279078

More details:

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

[2-(4-Bromophenyl)-4-morpholinyl]{4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanone [ACD/IUPAC Name]
[2-(4-Bromophényl)-4-morpholinyl]{4-[3-(trifluorométhyl)-1H-pyrazol-1-yl]phényl}méthanone [French] [ACD/IUPAC Name]
[2-(4-Bromphenyl)-4-morpholinyl]{4-[3-(trifluormethyl)-1H-pyrazol-1-yl]phenyl}methanon [German] [ACD/IUPAC Name]
Methanone, [2-(4-bromophenyl)-4-morpholinyl][4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 573.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 300.6±30.1 °C
Index of Refraction: 1.620
Molar Refractivity: 110.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1322.17
ACD/KOC (pH 5.5): 5967.84
ACD/LogD (pH 7.4): 4.41
ACD/BCF (pH 7.4): 1322.17
ACD/KOC (pH 7.4): 5967.84
Polar Surface Area: 47 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 313.1±7.0 cm3

Click to predict properties on the Chemicalize site


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