ChemSpider 2D Image | (2S)-2-Amino-2-(2-fluoro-4-nitrophenyl)ethanol | C8H9FN2O3

(2S)-2-Amino-2-(2-fluoro-4-nitrophenyl)ethanol

  • Molecular FormulaC8H9FN2O3
  • Average mass200.167 Da
  • Monoisotopic mass200.059723 Da
  • ChemSpider ID27467568

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Amino-2-(2-fluor-4-nitrophenyl)ethanol [German] [ACD/IUPAC Name]
(2S)-2-Amino-2-(2-fluoro-4-nitrophenyl)ethanol [ACD/IUPAC Name]
(2S)-2-Amino-2-(2-fluoro-4-nitrophényl)éthanol [French] [ACD/IUPAC Name]
Benzeneethanol, β-amino-2-fluoro-4-nitro-, (βS)- [ACD/Index Name]
(2S)-2-AMINO-2-(2-FLUORO-4-NITROPHENYL)ETHAN-1-OL
1212891-72-9 [RN]
MFCD11509880

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 384.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 66.7±3.0 kJ/mol
    Flash Point: 186.1±27.9 °C
    Index of Refraction: 1.591
    Molar Refractivity: 47.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.10
    ACD/LogD (pH 5.5): -2.44
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.92
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.86
    Polar Surface Area: 92 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 60.4±3.0 dyne/cm
    Molar Volume: 140.2±3.0 cm3

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