ChemSpider 2D Image | 1-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitro-1-propanimine | C12H14N2O7

1-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitro-1-propanimine

  • Molecular FormulaC12H14N2O7
  • Average mass298.249 Da
  • Monoisotopic mass298.080109 Da
  • ChemSpider ID35386772

More details:

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

1-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitro-1-propanimin [German] [ACD/IUPAC Name]
1-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitro-1-propanimine [ACD/IUPAC Name]
1-(6,7-Diméthoxy-1,3-benzodioxol-5-yl)-N-hydroxy-2-nitro-1-propanimine [French] [ACD/IUPAC Name]
1-Propanone, 1-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-nitro-, oxime [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: 456.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 229.7±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 67.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.90
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 50.9±7.0 dyne/cm
Molar Volume: 199.5±7.0 cm3

Click to predict properties on the Chemicalize site


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