ChemSpider 2D Image | 6-Fluoro-1H-indole-3-carbonitrile | C9H5FN2

6-Fluoro-1H-indole-3-carbonitrile

  • Molecular FormulaC9H5FN2
  • Average mass160.148 Da
  • Monoisotopic mass160.043671 Da
  • ChemSpider ID26551267

More details:

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

1043601-53-1 [RN]
1H-Indole-3-carbonitrile, 6-fluoro- [ACD/Index Name]
6-Fluor-1H-indol-3-carbonitril [German] [ACD/IUPAC Name]
6-Fluoro-1H-indole-3-carbonitrile [ACD/IUPAC Name]
6-Fluoro-1H-indole-3-carbonitrile [French] [ACD/IUPAC Name]
[1043601-53-1] [RN]
1011484-23-3 [RN]
6-Fluoro-3-carbonitrile
6-Fluoro-3-methyl-1H-indole [ACD/IUPAC Name]
MFCD12964694 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 353.3±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.8±3.0 kJ/mol
    Flash Point: 167.5±22.3 °C
    Index of Refraction: 1.642
    Molar Refractivity: 42.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.37
    ACD/LogD (pH 5.5): 2.23
    ACD/BCF (pH 5.5): 29.43
    ACD/KOC (pH 5.5): 391.77
    ACD/LogD (pH 7.4): 2.23
    ACD/BCF (pH 7.4): 29.43
    ACD/KOC (pH 7.4): 391.77
    Polar Surface Area: 40 Å2
    Polarizability: 17.0±0.5 10-24cm3
    Surface Tension: 57.2±5.0 dyne/cm
    Molar Volume: 118.8±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement