ChemSpider 2D Image | Ethyl 6-bromo-4-fluoro-1H-indole-2-carboxylate | C11H9BrFNO2

Ethyl 6-bromo-4-fluoro-1H-indole-2-carboxylate

  • Molecular FormulaC11H9BrFNO2
  • Average mass286.097 Da
  • Monoisotopic mass284.980072 Da
  • ChemSpider ID25997221

More details:

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

1H-Indole-2-carboxylic acid, 6-bromo-4-fluoro-, ethyl ester [ACD/Index Name]
396075-55-1 [RN]
6-Bromo-4-fluoro-1H-indole-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-bromo-4-fluoro-1H-indole-2-carboxylate [ACD/IUPAC Name]
Ethyl-6-brom-4-fluor-1H-indol-2-carboxylat [German] [ACD/IUPAC Name]
6-bromo-4-fluoro-1H-Indole-2-carboxylic acid, ethyl ester
6-bromo-4-fluoro-1H-Indole-2-carboxylicacid,ethylester
MFCD12412804 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 393.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 191.9±26.5 °C
Index of Refraction: 1.627
Molar Refractivity: 62.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 398.69
ACD/KOC (pH 5.5): 2530.12
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 398.69
ACD/KOC (pH 7.4): 2530.12
Polar Surface Area: 42 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 176.7±3.0 cm3

Click to predict properties on the Chemicalize site


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