ChemSpider 2D Image | 2-[3-Cyclobutyl-4-iodo-5-(trifluoromethyl)-1H-pyrazol-1-yl]-4-cyclohexylpyridine | C19H21F3IN3

2-[3-Cyclobutyl-4-iodo-5-(trifluoromethyl)-1H-pyrazol-1-yl]-4-cyclohexylpyridine

  • Molecular FormulaC19H21F3IN3
  • Average mass475.290 Da
  • Monoisotopic mass475.073212 Da
  • ChemSpider ID122032504

More details:

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

2-[3-Cyclobutyl-4-iod-5-(trifluormethyl)-1H-pyrazol-1-yl]-4-cyclohexylpyridin [German] [ACD/IUPAC Name]
2-[3-Cyclobutyl-4-iodo-5-(trifluoromethyl)-1H-pyrazol-1-yl]-4-cyclohexylpyridine [ACD/IUPAC Name]
2-[3-Cyclobutyl-4-iodo-5-(trifluorométhyl)-1H-pyrazol-1-yl]-4-cyclohexylpyridine [French] [ACD/IUPAC Name]
Pyridine, 2-[3-cyclobutyl-4-iodo-5-(trifluoromethyl)-1H-pyrazol-1-yl]-4-cyclohexyl- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 473.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 240.0±28.7 °C
Index of Refraction: 1.667
Molar Refractivity: 102.8±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.09
ACD/LogD (pH 5.5): 6.18
ACD/BCF (pH 5.5): 29455.04
ACD/KOC (pH 5.5): 55031.04
ACD/LogD (pH 7.4): 6.18
ACD/BCF (pH 7.4): 29455.36
ACD/KOC (pH 7.4): 55031.65
Polar Surface Area: 31 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 276.2±7.0 cm3

Click to predict properties on the Chemicalize site


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