ChemSpider 2D Image | 1-[(1R,2S)-2-(Methoxymethyl)cyclopentyl]-2-[2-(trifluoromethyl)phenyl]-1H-imidazole | C17H19F3N2O

1-[(1R,2S)-2-(Methoxymethyl)cyclopentyl]-2-[2-(trifluoromethyl)phenyl]-1H-imidazole

  • Molecular FormulaC17H19F3N2O
  • Average mass324.341 Da
  • Monoisotopic mass324.144958 Da
  • ChemSpider ID29528054

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-[(1R,2S)-2-(Methoxymethyl)cyclopentyl]-2-[2-(trifluormethyl)phenyl]-1H-imidazol [German] [ACD/IUPAC Name]
1-[(1R,2S)-2-(Methoxymethyl)cyclopentyl]-2-[2-(trifluoromethyl)phenyl]-1H-imidazole [ACD/IUPAC Name]
1-[(1R,2S)-2-(Méthoxyméthyl)cyclopentyl]-2-[2-(trifluorométhyl)phényl]-1H-imidazole [French] [ACD/IUPAC Name]
1H-Imidazole, 1-[(1R,2S)-2-(methoxymethyl)cyclopentyl]-2-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-[(1R*,2S*)-2-(methoxymethyl)cyclopentyl]-2-[2-(trifluoromethyl)phenyl]-1H-imidazole

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

Density: 1.3±0.1 g/cm3
Boiling Point: 423.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 209.7±31.5 °C
Index of Refraction: 1.551
Molar Refractivity: 81.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 191.81
ACD/KOC (pH 5.5): 1078.44
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 594.03
ACD/KOC (pH 7.4): 3339.83
Polar Surface Area: 27 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 36.1±7.0 dyne/cm
Molar Volume: 255.9±7.0 cm3

Click to predict properties on the Chemicalize site


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