ChemSpider 2D Image | 2-Bromo-6-methylbenzotrifluoride | C8H6BrF3

2-Bromo-6-methylbenzotrifluoride

  • Molecular FormulaC8H6BrF3
  • Average mass239.032 Da
  • Monoisotopic mass237.960495 Da
  • ChemSpider ID21436726

More details:

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

1-Brom-3-methyl-2-(trifluormethyl)benzol [German] [ACD/IUPAC Name]
1-Bromo-3-methyl-2-(trifluoromethyl)benzene [ACD/IUPAC Name]
1-Bromo-3-méthyl-2-(trifluorométhyl)benzène [French] [ACD/IUPAC Name]
2-Bromo-6-methylbenzotrifluoride
944268-56-8 [RN]
Benzene, 1-bromo-3-methyl-2-(trifluoromethyl)- [ACD/Index Name]
MFCD01631583 [MDL number]
[944268-56-8] [RN]
69902-83-6 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 190.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.9±3.0 kJ/mol
Flash Point: 76.4±21.8 °C
Index of Refraction: 1.475
Molar Refractivity: 43.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 564.78
ACD/KOC (pH 5.5): 3246.35
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 564.78
ACD/KOC (pH 7.4): 3246.35
Polar Surface Area: 0 Å2
Polarizability: 17.3±0.5 10-24cm3
Surface Tension: 26.5±3.0 dyne/cm
Molar Volume: 155.4±3.0 cm3

Click to predict properties on the Chemicalize site


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