ChemSpider 2D Image | 6-(Trifluoromethoxy)-1H-indole-3-carboxylic acid | C10H6F3NO3

6-(Trifluoromethoxy)-1H-indole-3-carboxylic acid

  • Molecular FormulaC10H6F3NO3
  • Average mass245.155 Da
  • Monoisotopic mass245.029984 Da
  • ChemSpider ID26551228

More details:

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

1H-Indole-3-carboxylic acid, 6-(trifluoromethoxy)- [ACD/Index Name]
6-(Trifluormethoxy)-1H-indol-3-carbonsäure [German] [ACD/IUPAC Name]
6-(Trifluoromethoxy)-1H-indole-3-carboxylic acid [ACD/IUPAC Name]
959238-96-1 [RN]
Acide 6-(trifluorométhoxy)-1H-indole-3-carboxylique [French] [ACD/IUPAC Name]
MFCD09954948

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

Density: 1.6±0.1 g/cm3
Boiling Point: 387.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 187.9±26.5 °C
Index of Refraction: 1.595
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.08
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 62 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 154.8±3.0 cm3

Click to predict properties on the Chemicalize site


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