ChemSpider 2D Image | N~2~-{4-[(3,5-Dinitrobenzoyl)amino]butanoyl}glutamine | C16H19N5O9

N2-{4-[(3,5-Dinitrobenzoyl)amino]butanoyl}glutamine

  • Molecular FormulaC16H19N5O9
  • Average mass425.350 Da
  • Monoisotopic mass425.118286 Da
  • ChemSpider ID60200955

More details:

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

Glutamine, N2-[4-[(3,5-dinitrobenzoyl)amino]-1-oxobutyl]- [ACD/Index Name]
N2-{4-[(3,5-Dinitrobenzoyl)amino]butanoyl}glutamin [German] [ACD/IUPAC Name]
N2-{4-[(3,5-Dinitrobenzoyl)amino]butanoyl}glutamine [ACD/IUPAC Name]
N2-{4-[(3,5-Dinitrobenzoyl)amino]butanoyl}glutamine [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: 824.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 452.4±34.3 °C
Index of Refraction: 1.604
Molar Refractivity: 98.7±0.3 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -1.13
ACD/LogD (pH 5.5): -3.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 230 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 71.7±3.0 dyne/cm
Molar Volume: 287.3±3.0 cm3

Click to predict properties on the Chemicalize site


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