ChemSpider 2D Image | 2-[(1S)-1-Amino-2-hydroxyethyl]-4-fluoro-6-nitrophenol | C8H9FN2O4

2-[(1S)-1-Amino-2-hydroxyethyl]-4-fluoro-6-nitrophenol

  • Molecular FormulaC8H9FN2O4
  • Average mass216.167 Da
  • Monoisotopic mass216.054642 Da
  • ChemSpider ID27468028

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(1S)-1-Amino-2-hydroxyethyl]-4-fluor-6-nitrophenol [German] [ACD/IUPAC Name]
2-[(1S)-1-Amino-2-hydroxyethyl]-4-fluoro-6-nitrophenol [ACD/IUPAC Name]
2-[(1S)-1-Amino-2-hydroxyéthyl]-4-fluoro-6-nitrophénol [French] [ACD/IUPAC Name]
Benzeneethanol, β-amino-5-fluoro-2-hydroxy-3-nitro-, (βS)- [ACD/Index Name]
2-((1S)-1-AMINO-2-HYDROXYETHYL)-4-FLUORO-6-NITROPHENOL
MFCD11509946

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 389.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 67.3±3.0 kJ/mol
    Flash Point: 189.1±27.9 °C
    Index of Refraction: 1.629
    Molar Refractivity: 49.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.09
    ACD/LogD (pH 5.5): -2.56
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 112 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 73.4±3.0 dyne/cm
    Molar Volume: 138.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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