ChemSpider 2D Image | 4-(Trifluoromethyl)-1H-indole-3-carboxylic acid | C10H6F3NO2

4-(Trifluoromethyl)-1H-indole-3-carboxylic acid

  • Molecular FormulaC10H6F3NO2
  • Average mass229.155 Da
  • Monoisotopic mass229.035065 Da
  • ChemSpider ID25950207

More details:

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

1H-Indole-3-carboxylic acid, 4-(trifluoromethyl)- [ACD/Index Name]
4-(Trifluormethyl)-1H-indol-3-carbonsäure [German] [ACD/IUPAC Name]
4-(Trifluoromethyl)-1H-indole-3-carboxylic acid [ACD/IUPAC Name]
959238-76-7 [RN]
Acide 4-(trifluorométhyl)-1H-indole-3-carboxylique [French] [ACD/IUPAC Name]
1H-INDOLE-3-CARBOXYLIC ACID,4-(TRIFLUOROMETHYL)-
256924-07-9 [RN]
4-(3-Dimethylamino-propoxy)-benzaldehyde
4-(Trifluoromethyl)indole-3-carboxylic acid
4-(Trifluoromethyl)-indole-3-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 402.5±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.9±3.0 kJ/mol
    Flash Point: 197.2±27.3 °C
    Index of Refraction: 1.598
    Molar Refractivity: 50.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.56
    ACD/LogD (pH 5.5): 0.35
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.21
    ACD/LogD (pH 7.4): -0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 53 Å2
    Polarizability: 20.0±0.5 10-24cm3
    Surface Tension: 48.4±3.0 dyne/cm
    Molar Volume: 147.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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