ChemSpider 2D Image | 1-Bromo-4-fluoro-2-(2,2,2-trifluoroethyl)benzene | C8H5BrF4

1-Bromo-4-fluoro-2-(2,2,2-trifluoroethyl)benzene

  • Molecular FormulaC8H5BrF4
  • Average mass257.023 Da
  • Monoisotopic mass255.951065 Da
  • ChemSpider ID26051893

More details:

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

1186194-80-8 [RN]
1-Brom-4-fluor-2-(2,2,2-trifluorethyl)benzol [German] [ACD/IUPAC Name]
1-Bromo-4-fluoro-2-(2,2,2-trifluoroethyl)benzene [ACD/IUPAC Name]
1-Bromo-4-fluoro-2-(2,2,2-trifluoroéthyl)benzène [French] [ACD/IUPAC Name]
Benzene, 1-bromo-4-fluoro-2-(2,2,2-trifluoroethyl)- [ACD/Index Name]
MFCD11226691 [MDL number]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      26-37-60 Alfa Aesar H33404
      36/37/38 Alfa Aesar H33404
      H315-H319-H335 Alfa Aesar H33404
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar H33404
      Warning Alfa Aesar H33404

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

Density: 1.6±0.1 g/cm3
Boiling Point: 180.8±40.0 °C at 760 mmHg
Vapour Pressure: 1.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.0±3.0 kJ/mol
Flash Point: 81.8±11.4 °C
Index of Refraction: 1.465
Molar Refractivity: 43.9±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 318.10
ACD/KOC (pH 5.5): 2152.48
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 318.10
ACD/KOC (pH 7.4): 2152.48
Polar Surface Area: 0 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 27.8±3.0 dyne/cm
Molar Volume: 159.0±3.0 cm3

Click to predict properties on the Chemicalize site


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