ChemSpider 2D Image | 6-(3-Fluorophenyl)nicotinaldehyde | C12H8FNO

6-(3-Fluorophenyl)nicotinaldehyde

  • Molecular FormulaC12H8FNO
  • Average mass201.196 Da
  • Monoisotopic mass201.058990 Da
  • ChemSpider ID21540766

More details:

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

3-Pyridinecarboxaldehyde, 6-(3-fluorophenyl)- [ACD/Index Name]
6-(3-Fluorophenyl)nicotinaldehyde [ACD/IUPAC Name]
6-(3-Fluorophényl)nicotinaldéhyde [French] [ACD/IUPAC Name]
6-(3-FLUOROPHENYL)PYRIDINE-3-CARBOXALDEHYDE
6-(3-Fluorphenyl)nicotinaldehyd [German] [ACD/IUPAC Name]
898795-81-8 [RN]
MFCD04115444 [MDL number]
[898795-81-8] [RN]
4-(3-(4-hydroxybutyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile;RU58841
6-(3-Fluorophenyl)-3-pyridinecarbaldehyde
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

RU 58841 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 341.5±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.5±3.0 kJ/mol
    Flash Point: 160.3±25.1 °C
    Index of Refraction: 1.595
    Molar Refractivity: 55.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.38
    ACD/LogD (pH 5.5): 2.31
    ACD/BCF (pH 5.5): 33.62
    ACD/KOC (pH 5.5): 430.79
    ACD/LogD (pH 7.4): 2.31
    ACD/BCF (pH 7.4): 33.64
    ACD/KOC (pH 7.4): 431.03
    Polar Surface Area: 30 Å2
    Polarizability: 22.1±0.5 10-24cm3
    Surface Tension: 46.1±3.0 dyne/cm
    Molar Volume: 163.8±3.0 cm3

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