ChemSpider 2D Image | MFCD28348659 | C9H9FO4

MFCD28348659

  • Molecular FormulaC9H9FO4
  • Average mass200.164 Da
  • Monoisotopic mass200.048492 Da
  • ChemSpider ID32821535

More details:

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

1785030-01-4 [RN]
4-Fluor-3,5-dimethoxybenzoesäure [German] [ACD/IUPAC Name]
4-Fluoro-3,5-dimethoxybenzoic acid [ACD/IUPAC Name]
Acide 4-fluoro-3,5-diméthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-fluoro-3,5-dimethoxy- [ACD/Index Name]
MFCD28348659
3,5-dimethoxy-4-fluorobenzoic acid
CS-11928

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 356.9±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 169.6±26.5 °C
    Index of Refraction: 1.516
    Molar Refractivity: 46.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.10
    ACD/LogD (pH 5.5): 0.66
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 10.20
    ACD/LogD (pH 7.4): -0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 56 Å2
    Polarizability: 18.4±0.5 10-24cm3
    Surface Tension: 40.9±3.0 dyne/cm
    Molar Volume: 154.2±3.0 cm3

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