ChemSpider 2D Image | 3,3'-Dinitro-5,5'-bi-1,2-oxazole | C6H2N4O6

3,3'-Dinitro-5,5'-bi-1,2-oxazole

  • Molecular FormulaC6H2N4O6
  • Average mass226.103 Da
  • Monoisotopic mass225.997437 Da
  • ChemSpider ID62971738

More details:

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

3,3'-Dinitro-5,5'-bi-1,2-oxazol [German] [ACD/IUPAC Name]
3,3'-Dinitro-5,5'-bi-1,2-oxazole [ACD/IUPAC Name]
3,3'-Dinitro-5,5'-bi-1,2-oxazole [French] [ACD/IUPAC Name]
40995-07-1 [RN]
5,5'-Biisoxazole, 3,3'-dinitro- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 526.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 272.2±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 44.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.04
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.02
ACD/KOC (pH 5.5): 35.24
ACD/LogD (pH 7.4): 0.31
ACD/BCF (pH 7.4): 1.02
ACD/KOC (pH 7.4): 35.24
Polar Surface Area: 144 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 78.2±3.0 dyne/cm
Molar Volume: 130.4±3.0 cm3

Click to predict properties on the Chemicalize site


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