ChemSpider 2D Image | 1-[3,4-Bis(trifluoromethyl)phenyl]-1-bromoacetone | C11H7BrF6O

1-[3,4-Bis(trifluoromethyl)phenyl]-1-bromoacetone

  • Molecular FormulaC11H7BrF6O
  • Average mass349.067 Da
  • Monoisotopic mass347.958435 Da
  • ChemSpider ID77381769

More details:

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

1-[3,4-Bis(trifluormethyl)phenyl]-1-bromaceton [German] [ACD/IUPAC Name]
1-[3,4-Bis(trifluoromethyl)phenyl]-1-bromoacetone [ACD/IUPAC Name]
1-[3,4-Bis(trifluorométhyl)phényl]-1-bromoacétone [French] [ACD/IUPAC Name]
1-[3,4-bis(trifluoromethyl)phenyl]-1-bromopropan-2-one
1804222-55-6 [RN]
2-Propanone, 1-[3,4-bis(trifluoromethyl)phenyl]-1-bromo- [ACD/Index Name]
1-(3,4-Bis(trifluoromethyl)phenyl)-1-bromopropan-2-one

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

Density: 1.6±0.1 g/cm3
Boiling Point: 261.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.9±3.0 kJ/mol
Flash Point: 112.0±25.9 °C
Index of Refraction: 1.449
Molar Refractivity: 58.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 416.99
ACD/KOC (pH 5.5): 2612.72
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 416.99
ACD/KOC (pH 7.4): 2612.72
Polar Surface Area: 17 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 26.9±3.0 dyne/cm
Molar Volume: 216.8±3.0 cm3

Click to predict properties on the Chemicalize site


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