ChemSpider 2D Image | 4-Fluoro-N-(4-methyl-3,5-dinitrobenzoyl)phenylalanyl-N-[4-(dimethylamino)phenyl]glycinamide | C27H27FN6O7

4-Fluoro-N-(4-methyl-3,5-dinitrobenzoyl)phenylalanyl-N-[4-(dimethylamino)phenyl]glycinamide

  • Molecular FormulaC27H27FN6O7
  • Average mass566.538 Da
  • Monoisotopic mass566.192505 Da
  • ChemSpider ID121127909

More details:

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

4-Fluor-N-(4-methyl-3,5-dinitrobenzoyl)phenylalanyl-N-[4-(dimethylamino)phenyl]glycinamid [German] [ACD/IUPAC Name]
4-Fluoro-N-(4-methyl-3,5-dinitrobenzoyl)phenylalanyl-N-[4-(dimethylamino)phenyl]glycinamide [ACD/IUPAC Name]
4-Fluoro-N-(4-méthyl-3,5-dinitrobenzoyl)phénylalanyl-N-[4-(diméthylamino)phényl]glycinamide [French] [ACD/IUPAC Name]
Glycinamide, 4-fluoro-N-(4-methyl-3,5-dinitrobenzoyl)phenylalanyl-N-[4-(dimethylamino)phenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 822.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.5±3.0 kJ/mol
Flash Point: 451.0±34.3 °C
Index of Refraction: 1.649
Molar Refractivity: 147.9±0.3 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 63.19
ACD/KOC (pH 5.5): 484.07
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 199.86
ACD/KOC (pH 7.4): 1530.95
Polar Surface Area: 182 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 405.9±3.0 cm3

Click to predict properties on the Chemicalize site


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