ChemSpider 2D Image | 2-Bromo-1-[5-methyl-2,4-bis(trifluoromethyl)phenyl]ethanone | C11H7BrF6O

2-Bromo-1-[5-methyl-2,4-bis(trifluoromethyl)phenyl]ethanone

  • Molecular FormulaC11H7BrF6O
  • Average mass349.067 Da
  • Monoisotopic mass347.958435 Da
  • ChemSpider ID77360830

More details:

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

2-Brom-1-[5-methyl-2,4-bis(trifluormethyl)phenyl]ethanon [German] [ACD/IUPAC Name]
2-Bromo-1-[5-methyl-2,4-bis(trifluoromethyl)phenyl]ethanone [ACD/IUPAC Name]
2-Bromo-1-[5-méthyl-2,4-bis(trifluorométhyl)phényl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-bromo-1-[5-methyl-2,4-bis(trifluoromethyl)phenyl]- [ACD/Index Name]
1805105-97-8 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 280.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.9±3.0 kJ/mol
Flash Point: 123.4±27.3 °C
Index of Refraction: 1.453
Molar Refractivity: 58.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2151.51
ACD/KOC (pH 5.5): 8456.18
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2151.51
ACD/KOC (pH 7.4): 8456.18
Polar Surface Area: 17 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 27.2±3.0 dyne/cm
Molar Volume: 217.4±3.0 cm3

Click to predict properties on the Chemicalize site


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