ChemSpider 2D Image | Ethyl 2-fluoro-6-nitrobenzoate | C9H8FNO4

Ethyl 2-fluoro-6-nitrobenzoate

  • Molecular FormulaC9H8FNO4
  • Average mass213.163 Da
  • Monoisotopic mass213.043732 Da
  • ChemSpider ID23348654

More details:

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

2-Fluoro-6-nitrobenzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-6-nitro-, ethyl ester [ACD/Index Name]
Ethyl 2-fluoro-6-nitrobenzoate [ACD/IUPAC Name]
Ethyl-2-fluor-6-nitrobenzoat [German] [ACD/IUPAC Name]
1154426-16-0 [RN]
2-?fluoro-?6-?nitro-Benzoic acid?, ethyl ester
82911-69-1 [RN]
Ethyl2-Fluoro-6-nitrobenzoate
MFCD10566814 [MDL number]
ST-5850

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 297.2±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.7±3.0 kJ/mol
    Flash Point: 133.6±23.2 °C
    Index of Refraction: 1.528
    Molar Refractivity: 49.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 2.10
    ACD/BCF (pH 5.5): 23.22
    ACD/KOC (pH 5.5): 330.55
    ACD/LogD (pH 7.4): 2.10
    ACD/BCF (pH 7.4): 23.22
    ACD/KOC (pH 7.4): 330.55
    Polar Surface Area: 72 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 45.2±3.0 dyne/cm
    Molar Volume: 159.9±3.0 cm3

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