ChemSpider 2D Image | Ethyl N-benzyl-N-{4-[(3,5-dinitrobenzoyl)amino]butanoyl}glycinate | C22H24N4O8

Ethyl N-benzyl-N-{4-[(3,5-dinitrobenzoyl)amino]butanoyl}glycinate

  • Molecular FormulaC22H24N4O8
  • Average mass472.448 Da
  • Monoisotopic mass472.159424 Da
  • ChemSpider ID60213260

More details:

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

Ethyl N-benzyl-N-{4-[(3,5-dinitrobenzoyl)amino]butanoyl}glycinate [ACD/IUPAC Name]
Ethyl-N-benzyl-N-{4-[(3,5-dinitrobenzoyl)amino]butanoyl}glycinat [German] [ACD/IUPAC Name]
Glycine, N-[4-[(3,5-dinitrobenzoyl)amino]-1-oxobutyl]-N-(phenylmethyl)-, ethyl ester [ACD/Index Name]
N-Benzyl-N-{4-[(3,5-dinitrobenzoyl)amino]butanoyl}glycinate d'éthyle [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: 661.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 353.5±31.5 °C
Index of Refraction: 1.593
Molar Refractivity: 120.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.11
ACD/KOC (pH 5.5): 967.65
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 104.11
ACD/KOC (pH 7.4): 967.65
Polar Surface Area: 167 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 354.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement