ChemSpider 2D Image | Methyl 3-(4-fluoro-3-nitrophenyl)propanoate | C10H10FNO4

Methyl 3-(4-fluoro-3-nitrophenyl)propanoate

  • Molecular FormulaC10H10FNO4
  • Average mass227.189 Da
  • Monoisotopic mass227.059387 Da
  • ChemSpider ID38236278

More details:






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

3-(4-Fluoro-3-nitrophényl)propanoate de méthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-fluoro-3-nitro-, methyl ester [ACD/Index Name]
Methyl 3-(4-fluoro-3-nitrophenyl)propanoate [ACD/IUPAC Name]
Methyl-3-(4-fluor-3-nitrophenyl)propanoat [German] [ACD/IUPAC Name]
3-(4-Fluoro-3-nitro-phenyl)-propionic acid methyl ester
907602-44-2 [RN]
methyl 4-fluoro-3-nitrophenylpropanoate
MFCD27932044
SS-4969

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 334.4±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.7±3.0 kJ/mol
    Flash Point: 156.0±23.7 °C
    Index of Refraction: 1.523
    Molar Refractivity: 53.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.73
    ACD/LogD (pH 5.5): 2.08
    ACD/BCF (pH 5.5): 22.26
    ACD/KOC (pH 5.5): 320.79
    ACD/LogD (pH 7.4): 2.08
    ACD/BCF (pH 7.4): 22.26
    ACD/KOC (pH 7.4): 320.79
    Polar Surface Area: 72 Å2
    Polarizability: 21.2±0.5 10-24cm3
    Surface Tension: 44.2±3.0 dyne/cm
    Molar Volume: 174.8±3.0 cm3

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