ChemSpider 2D Image | 5-Chloro-N-(3,5-difluorobenzyl)-1H-indole-2-carboxamide | C16H11ClF2N2O

5-Chloro-N-(3,5-difluorobenzyl)-1H-indole-2-carboxamide

  • Molecular FormulaC16H11ClF2N2O
  • Average mass320.721 Da
  • Monoisotopic mass320.052795 Da
  • ChemSpider ID26008444

More details:






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

1H-Indole-2-carboxamide, 5-chloro-N-[(3,5-difluorophenyl)methyl]- [ACD/Index Name]
5-Chlor-N-(3,5-difluorbenzyl)-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
5-Chloro-N-(3,5-difluorobenzyl)-1H-indole-2-carboxamide [ACD/IUPAC Name]
5-Chloro-N-(3,5-difluorobenzyl)-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]
1252818-51-1 [RN]
5-Chloro-1H-indole-2-carboxylic acid 3,5-difluoro-benzylamide
5-chloro-N-[(3,5-difluorophenyl)methyl]-1H-indole-2-carboxamide

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 563.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.6±3.0 kJ/mol
    Flash Point: 294.3±30.1 °C
    Index of Refraction: 1.651
    Molar Refractivity: 81.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.82
    ACD/LogD (pH 5.5): 4.16
    ACD/BCF (pH 5.5): 855.69
    ACD/KOC (pH 5.5): 4370.71
    ACD/LogD (pH 7.4): 4.16
    ACD/BCF (pH 7.4): 855.69
    ACD/KOC (pH 7.4): 4370.70
    Polar Surface Area: 45 Å2
    Polarizability: 32.3±0.5 10-24cm3
    Surface Tension: 54.3±3.0 dyne/cm
    Molar Volume: 223.3±3.0 cm3

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