ChemSpider 2D Image | 4-[(4-Nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazole-3-carbonitrile | C5N6O5

4-[(4-Nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazole-3-carbonitrile

  • Molecular FormulaC5N6O5
  • Average mass224.091 Da
  • Monoisotopic mass223.993011 Da
  • ChemSpider ID21134527

More details:

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

1,2,5-Oxadiazole-3-carbonitrile, 4-[(4-nitro-1,2,5-oxadiazol-3-yl)oxy]- [ACD/Index Name]
4-[(4-Nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazol-3-carbonitril [German] [ACD/IUPAC Name]
4-[(4-Nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazole-3-carbonitrile [ACD/IUPAC Name]
4-[(4-Nitro-1,2,5-oxadiazol-3-yl)oxy]-1,2,5-oxadiazole-3-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 413.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 204.0±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 40.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.03
ACD/KOC (pH 5.5): 35.56
ACD/LogD (pH 7.4): 0.32
ACD/BCF (pH 7.4): 1.03
ACD/KOC (pH 7.4): 35.56
Polar Surface Area: 157 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 142.8±5.0 dyne/cm
Molar Volume: 114.3±5.0 cm3

Click to predict properties on the Chemicalize site


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