ChemSpider 2D Image | N~1~-(5-Fluoro-2-nitrophenyl)-L-aspartamide | C10H11FN4O4

N1-(5-Fluoro-2-nitrophenyl)-L-aspartamide

  • Molecular FormulaC10H11FN4O4
  • Average mass270.217 Da
  • Monoisotopic mass270.076447 Da
  • ChemSpider ID32158320

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Aspartamide, N1-(5-fluoro-2-nitrophenyl)- [ACD/Index Name]
N1-(5-Fluor-2-nitrophenyl)-L-aspartamid [German] [ACD/IUPAC Name]
N1-(5-Fluoro-2-nitrophenyl)-L-aspartamide [ACD/IUPAC Name]
N1-(5-Fluoro-2-nitrophényl)-L-aspartamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 589.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.3±30.1 °C
Index of Refraction: 1.638
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.74
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.29
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.68
Polar Surface Area: 144 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 71.9±3.0 dyne/cm
Molar Volume: 176.4±3.0 cm3

Click to predict properties on the Chemicalize site


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