ChemSpider 2D Image | 2-(5-Nitro-2-furyl)-1,3,4-oxadiazole | C6H3N3O4

2-(5-Nitro-2-furyl)-1,3,4-oxadiazole

  • Molecular FormulaC6H3N3O4
  • Average mass181.106 Da
  • Monoisotopic mass181.012360 Da
  • ChemSpider ID25995188

More details:

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

1,3,4-Oxadiazole, 2-(5-nitro-2-furanyl)- [ACD/Index Name]
2-(5-Nitro-2-furyl)-1,3,4-oxadiazol [German] [ACD/IUPAC Name]
2-(5-Nitro-2-furyl)-1,3,4-oxadiazole [ACD/IUPAC Name]
2-(5-Nitro-2-furyl)-1,3,4-oxadiazole [French] [ACD/IUPAC Name]
2-(5-nitrofuran-2-yl)-1,3,4-oxadiazole
89488-64-2 [RN]
MFCD12912744 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 331.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 154.0±30.7 °C
Index of Refraction: 1.557
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.28
ACD/LogD (pH 7.4): 0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.28
Polar Surface Area: 98 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 118.6±3.0 cm3

Click to predict properties on the Chemicalize site


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