ChemSpider 2D Image | 4-{[(2E)-2-{[(1E)-2,6-Diamino-1-hydroxy-1-hexen-1-yl]imino}-1-hydroxyethyl]amino}-5,5-dihydroxy-4-pentenamide | C13H25N5O5

4-{[(2E)-2-{[(1E)-2,6-Diamino-1-hydroxy-1-hexen-1-yl]imino}-1-hydroxyethyl]amino}-5,5-dihydroxy-4-pentenamide

  • Molecular FormulaC13H25N5O5
  • Average mass331.368 Da
  • Monoisotopic mass331.185577 Da
  • ChemSpider ID95787206

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{[(2E)-2-{[(1E)-2,6-Diamino-1-hydroxy-1-hexen-1-yl]imino}-1-hydroxyethyl]amino}-5,5-dihydroxy-4-pentenamid [German] [ACD/IUPAC Name]
4-{[(2E)-2-{[(1E)-2,6-Diamino-1-hydroxy-1-hexen-1-yl]imino}-1-hydroxyethyl]amino}-5,5-dihydroxy-4-pentenamide [ACD/IUPAC Name]
4-{[(2E)-2-{[(1E)-2,6-Diamino-1-hydroxy-1-hexén-1-yl]imino}-1-hydroxyéthyl]amino}-5,5-dihydroxy-4-penténamide [French] [ACD/IUPAC Name]
4-Pentenamide, 4-[[(2E)-2-[[(1E)-2,6-diamino-1-hydroxy-1-hexen-1-yl]imino]-1-hydroxyethyl]amino]-5,5-dihydroxy- [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: 713.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.2±6.0 kJ/mol
Flash Point: 385.3±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 78.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -4.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 200 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 64.2±7.0 dyne/cm
Molar Volume: 228.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement