ChemSpider 2D Image | Methyl 5-amino-2-fluoro-4-methoxybenzoate | C9H10FNO3

Methyl 5-amino-2-fluoro-4-methoxybenzoate

  • Molecular FormulaC9H10FNO3
  • Average mass199.179 Da
  • Monoisotopic mass199.064468 Da
  • ChemSpider ID45468435

More details:

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

5-Amino-2-fluoro-4-méthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-amino-2-fluoro-4-methoxy-, methyl ester [ACD/Index Name]
Methyl 5-amino-2-fluoro-4-methoxybenzoate [ACD/IUPAC Name]
Methyl-5-amino-2-fluor-4-methoxybenzoat [German] [ACD/IUPAC Name]
1785259-87-1 [RN]
CS-12222
Methyl 5-Amino-2-fluoro-4-methoxybenzoate?
MFCD23378835

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 330.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.3±3.0 kJ/mol
    Flash Point: 153.5±27.9 °C
    Index of Refraction: 1.532
    Molar Refractivity: 48.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.29
    ACD/LogD (pH 5.5): 1.47
    ACD/BCF (pH 5.5): 7.72
    ACD/KOC (pH 5.5): 149.90
    ACD/LogD (pH 7.4): 1.48
    ACD/BCF (pH 7.4): 7.79
    ACD/KOC (pH 7.4): 151.22
    Polar Surface Area: 62 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 42.0±3.0 dyne/cm
    Molar Volume: 157.8±3.0 cm3

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