ChemSpider 2D Image | ETHYL 2,6-DIMETHYL-4-FLUOROBENZOATE | C11H13FO2

ETHYL 2,6-DIMETHYL-4-FLUOROBENZOATE

  • Molecular FormulaC11H13FO2
  • Average mass196.218 Da
  • Monoisotopic mass196.089951 Da
  • ChemSpider ID24748284

More details:

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

4-Fluoro-2,6-diméthylbenzoate d'éthyle [French] [ACD/IUPAC Name]
773135-70-9 [RN]
Benzoic acid, 4-fluoro-2,6-dimethyl-, ethyl ester [ACD/Index Name]
ETHYL 2,6-DIMETHYL-4-FLUOROBENZOATE
Ethyl 4-fluoro-2,6-dimethylbenzoate [ACD/IUPAC Name]
Ethyl-4-fluor-2,6-dimethylbenzoat [German] [ACD/IUPAC Name]
[773135-70-9] [RN]
2,6-Dimethyl-4-fluorobenzoic acid ethyl ester
2,6-Dimethyl-4-fluorobenzoicacidethylester
5-Amino-4-bromo-2-fluorobenzonitrile [ACD/IUPAC Name]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 241.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.8±3.0 kJ/mol
Flash Point: 96.8±20.8 °C
Index of Refraction: 1.491
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 296.33
ACD/KOC (pH 5.5): 2046.01
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 296.33
ACD/KOC (pH 7.4): 2046.01
Polar Surface Area: 26 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 180.6±3.0 cm3

Click to predict properties on the Chemicalize site


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