ChemSpider 2D Image | 1-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-nitro-1H-imidazole | C12H10FN3O4

1-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-nitro-1H-imidazole

  • Molecular FormulaC12H10FN3O4
  • Average mass279.224 Da
  • Monoisotopic mass279.065521 Da
  • ChemSpider ID26212778

More details:

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

1-[(6-Fluor-4H-1,3-benzodioxin-8-yl)methyl]-4-nitro-1H-imidazol [German] [ACD/IUPAC Name]
1-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-nitro-1H-imidazole [ACD/IUPAC Name]
1-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)méthyl]-4-nitro-1H-imidazole [French] [ACD/IUPAC Name]
1H-Imidazole, 1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-nitro- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 514.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 264.9±30.1 °C
Index of Refraction: 1.662
Molar Refractivity: 65.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.88
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 5.19
ACD/KOC (pH 5.5): 113.06
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 5.19
ACD/KOC (pH 7.4): 113.06
Polar Surface Area: 82 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 59.2±7.0 dyne/cm
Molar Volume: 177.1±7.0 cm3

Click to predict properties on the Chemicalize site


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