Found 682 results

Search term: MF = 'C_{12}H_{8}F_{3}N_{3}'
ChemSpider 2D Image | 1-[2-(Trifluoromethyl)benzyl]-1H-imidazole-2-carbonitrile | C12H8F3N3

1-[2-(Trifluoromethyl)benzyl]-1H-imidazole-2-carbonitrile

  • Molecular FormulaC12H8F3N3
  • Average mass251.207 Da
  • Monoisotopic mass251.067032 Da
  • ChemSpider ID60567706

More details:

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

1-[2-(Trifluormethyl)benzyl]-1H-imidazol-2-carbonitril [German] [ACD/IUPAC Name]
1-[2-(Trifluoromethyl)benzyl]-1H-imidazole-2-carbonitrile [ACD/IUPAC Name]
1-[2-(Trifluorométhyl)benzyl]-1H-imidazole-2-carbonitrile [French] [ACD/IUPAC Name]
1H-Imidazole-2-carbonitrile, 1-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
1-{[2-(TRIFLUOROMETHYL)PHENYL]METHYL}-1H-IMIDAZOLE-2-CARBONITRILE
1-{[2-(TRIFLUOROMETHYL)PHENYL]METHYL}IMIDAZOLE-2-CARBONITRILE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 359.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 171.0±30.7 °C
Index of Refraction: 1.546
Molar Refractivity: 61.8±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.26
ACD/KOC (pH 5.5): 463.75
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.27
ACD/KOC (pH 7.4): 463.89
Polar Surface Area: 42 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 38.0±7.0 dyne/cm
Molar Volume: 195.2±7.0 cm3

Click to predict properties on the Chemicalize site


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