ChemSpider 2D Image | 4-{Hydroxy[N~5~-(N-nitrocarbamimidoyl)ornithyl]amino}prolinamide | C11H22N8O5

4-{Hydroxy[N5-(N-nitrocarbamimidoyl)ornithyl]amino}prolinamide

  • Molecular FormulaC11H22N8O5
  • Average mass346.343 Da
  • Monoisotopic mass346.171326 Da
  • ChemSpider ID22376298

More details:

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

2-Pyrrolidinecarboxamide, 4-[[2-amino-5-[[imino(nitroamino)methyl]amino]-1-oxopentyl]hydroxyamino]- [ACD/Index Name]
4-{Hydroxy[N5-(N-nitrocarbamimidoyl)ornithyl]amino}prolinamid [German] [ACD/IUPAC Name]
4-{Hydroxy[N5-(N-nitrocarbamimidoyl)ornithyl]amino}prolinamide [ACD/IUPAC Name]
4-{Hydroxy[N5-(N-nitrocarbamimidoyl)ornithyl]amino}prolinamide [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 651.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.9±6.0 kJ/mol
Flash Point: 347.7±34.3 °C
Index of Refraction: 1.736
Molar Refractivity: 77.8±0.5 cm3
#H bond acceptors: 13
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -3.95
ACD/LogD (pH 5.5): -6.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 215 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 93.1±7.0 dyne/cm
Molar Volume: 193.7±7.0 cm3

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