ChemSpider 2D Image | N-(2-{[(4-Isobutoxyphenyl)carbamoyl]amino}ethyl)-3,5-dinitrobenzamide | C20H23N5O7

N-(2-{[(4-Isobutoxyphenyl)carbamoyl]amino}ethyl)-3,5-dinitrobenzamide

  • Molecular FormulaC20H23N5O7
  • Average mass445.426 Da
  • Monoisotopic mass445.159760 Da
  • ChemSpider ID59581268

More details:

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

Benzamide, N-[2-[[[[4-(2-methylpropoxy)phenyl]amino]carbonyl]amino]ethyl]-3,5-dinitro- [ACD/Index Name]
N-(2-{[(4-Isobutoxyphenyl)carbamoyl]amino}ethyl)-3,5-dinitrobenzamid [German] [ACD/IUPAC Name]
N-(2-{[(4-Isobutoxyphenyl)carbamoyl]amino}ethyl)-3,5-dinitrobenzamide [ACD/IUPAC Name]
N-(2-{[(4-Isobutoxyphényl)carbamoyl]amino}éthyl)-3,5-dinitrobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 611.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.3±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 115.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.84
ACD/KOC (pH 5.5): 486.54
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.84
ACD/KOC (pH 7.4): 486.52
Polar Surface Area: 171 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 330.2±3.0 cm3

Click to predict properties on the Chemicalize site


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