ChemSpider 2D Image | (E)-N~5~-{Amino[(1-carboxyethyl)amino]methylene}ornithine | C9H18N4O4

(E)-N5-{Amino[(1-carboxyethyl)amino]methylene}ornithine

  • Molecular FormulaC9H18N4O4
  • Average mass246.264 Da
  • Monoisotopic mass246.132813 Da
  • ChemSpider ID128917214

More details:

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

(E)-N5-{Amino[(1-carboxyethyl)amino]methylen}ornithin [German] [ACD/IUPAC Name]
(E)-N5-{Amino[(1-carboxyethyl)amino]methylene}ornithine [ACD/IUPAC Name]
(E)-N5-{Amino[(1-carboxyéthyl)amino]méthylène}ornithine [French] [ACD/IUPAC Name]
Ornithine, N5-[amino[(1-carboxyethyl)amino]methylene]-, (E)- [ACD/Index 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: 502.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 84.4±6.0 kJ/mol
Flash Point: 257.4±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 57.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -0.97
ACD/LogD (pH 5.5): -3.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 60.5±7.0 dyne/cm
Molar Volume: 168.8±7.0 cm3

Click to predict properties on the Chemicalize site


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