ChemSpider 2D Image | 1-(2-Chloro-6-fluorobenzyl)-1H-indole-5-carboxylic acid | C16H11ClFNO2

1-(2-Chloro-6-fluorobenzyl)-1H-indole-5-carboxylic acid

  • Molecular FormulaC16H11ClFNO2
  • Average mass303.715 Da
  • Monoisotopic mass303.046234 Da
  • ChemSpider ID43723962

More details:

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

1-(2-Chlor-6-fluorbenzyl)-1H-indol-5-carbonsäure [German] [ACD/IUPAC Name]
1-(2-Chloro-6-fluorobenzyl)-1H-indole-5-carboxylic acid [ACD/IUPAC Name]
1H-Indole-5-carboxylic acid, 1-[(2-chloro-6-fluorophenyl)methyl]- [ACD/Index Name]
Acide 1-(2-chloro-6-fluorobenzyl)-1H-indole-5-carboxylique [French] [ACD/IUPAC Name]
1-[(2-CHLORO-6-FLUOROPHENYL)METHYL]-1H-INDOLE-5-CARBOXYLIC ACID
1-[(2-CHLORO-6-FLUOROPHENYL)METHYL]INDOLE-5-CARBOXYLIC ACID
1483253-78-6 [RN]
VS-13276

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 513.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.7±3.0 kJ/mol
    Flash Point: 264.6±28.7 °C
    Index of Refraction: 1.627
    Molar Refractivity: 78.8±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.13
    ACD/LogD (pH 5.5): 3.81
    ACD/BCF (pH 5.5): 245.99
    ACD/KOC (pH 5.5): 841.10
    ACD/LogD (pH 7.4): 2.18
    ACD/BCF (pH 7.4): 5.78
    ACD/KOC (pH 7.4): 19.75
    Polar Surface Area: 42 Å2
    Polarizability: 31.2±0.5 10-24cm3
    Surface Tension: 47.1±7.0 dyne/cm
    Molar Volume: 222.2±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement