ChemSpider 2D Image | N~2~-(5-Fluoro-2,4-dinitrophenyl)-L-(3,3,3-~2~H_3_)alaninamide | C9H6D3FN4O5

N2-(5-Fluoro-2,4-dinitrophenyl)-L-(3,3,3-2H3)alaninamide

  • Molecular FormulaC9H6D3FN4O5
  • Average mass275.208 Da
  • Monoisotopic mass275.074524 Da
  • ChemSpider ID128942967

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

N2-(5-Fluor-2,4-dinitrophenyl)-L-(3,3,3-2H3)alaninamid [German] [ACD/IUPAC Name]
N2-(5-Fluoro-2,4-dinitrophenyl)-L-(3,3,3-2H3)alaninamide [ACD/IUPAC Name]
N2-(5-Fluoro-2,4-dinitrophényl)-L-(3,3,3-2H3)alaninamide [French] [ACD/IUPAC Name]
Propanamide-3,3,3-d3, 2-[(5-fluoro-2,4-dinitrophenyl)amino]-, (2S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 544.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 283.1±30.1 °C
Index of Refraction: 1.642
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.54
ACD/KOC (pH 5.5): 187.81
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 10.54
ACD/KOC (pH 7.4): 187.81
Polar Surface Area: 147 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 70.4±3.0 dyne/cm
Molar Volume: 171.0±3.0 cm3

Click to predict properties on the Chemicalize site


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