ChemSpider 2D Image | Methyl 4-bromo-5-chloro-2-fluorobenzoate | C8H5BrClFO2

Methyl 4-bromo-5-chloro-2-fluorobenzoate

  • Molecular FormulaC8H5BrClFO2
  • Average mass267.479 Da
  • Monoisotopic mass265.914551 Da
  • ChemSpider ID29356286

More details:

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

1379366-11-6 [RN]
4-Bromo-5-chloro-2-fluorobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-bromo-5-chloro-2-fluoro-, methyl ester [ACD/Index Name]
Methyl 4-bromo-5-chloro-2-fluorobenzoate [ACD/IUPAC Name]
Methyl-4-brom-5-chlor-2-fluorbenzoat [German] [ACD/IUPAC Name]
MFCD12032201

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

Density: 1.7±0.1 g/cm3
Boiling Point: 313.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 143.6±27.9 °C
Index of Refraction: 1.547
Molar Refractivity: 50.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 310.84
ACD/KOC (pH 5.5): 2117.23
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 310.84
ACD/KOC (pH 7.4): 2117.23
Polar Surface Area: 26 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 159.7±3.0 cm3

Click to predict properties on the Chemicalize site


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