ChemSpider 2D Image | 2-Fluoro-3-hydroxybenzonitrile | C7H4FNO

2-Fluoro-3-hydroxybenzonitrile

  • Molecular FormulaC7H4FNO
  • Average mass137.111 Da
  • Monoisotopic mass137.027695 Da
  • ChemSpider ID13792473

More details:

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

1000339-24-1 [RN]
2-Fluor-3-hydroxybenzonitril [German] [ACD/IUPAC Name]
2-Fluoro-3-hydroxybenzonitrile [ACD/IUPAC Name]
2-Fluoro-3-hydroxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-fluoro-3-hydroxy- [ACD/Index Name]
[1000339-24-1] [RN]
'1000339-24-1 [EINECS]
2-Fluoro-3-hydroxy benzonitrile
3-Cyano-2-fluorophenol
CA-4540
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 232.0±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.8±3.0 kJ/mol
    Flash Point: 94.1±23.2 °C
    Index of Refraction: 1.559
    Molar Refractivity: 33.0±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.73
    ACD/LogD (pH 5.5): 1.74
    ACD/BCF (pH 5.5): 12.42
    ACD/KOC (pH 5.5): 210.35
    ACD/LogD (pH 7.4): 1.41
    ACD/BCF (pH 7.4): 5.75
    ACD/KOC (pH 7.4): 97.33
    Polar Surface Area: 44 Å2
    Polarizability: 13.1±0.5 10-24cm3
    Surface Tension: 53.0±5.0 dyne/cm
    Molar Volume: 102.2±5.0 cm3

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