ChemSpider 2D Image | 4'-[2-(Trifluoromethyl)phenyl]-2,2':6',2''-terpyridine | C22H14F3N3

4'-[2-(Trifluoromethyl)phenyl]-2,2':6',2''-terpyridine

  • Molecular FormulaC22H14F3N3
  • Average mass377.362 Da
  • Monoisotopic mass377.113983 Da
  • ChemSpider ID24741623

More details:

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

2,2':6',2''-Terpyridine, 4'-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
4'-[2-(Trifluormethyl)phenyl]-2,2':6',2''-terpyridin [German] [ACD/IUPAC Name]
4'-[2-(Trifluoromethyl)phenyl]-2,2':6',2''-terpyridine [ACD/IUPAC Name]
4'-[2-(Trifluorométhyl)phényl]-2,2':6',2''-terpyridine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 247.2±28.7 °C
Index of Refraction: 1.580
Molar Refractivity: 99.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.54
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5591.82
ACD/KOC (pH 5.5): 16417.29
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5998.99
ACD/KOC (pH 7.4): 17612.73
Polar Surface Area: 39 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 298.5±3.0 cm3

Click to predict properties on the Chemicalize site


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