ChemSpider 2D Image | 4-carboxy-1,2,5-oxadiazol-2-ium-2-olate | C3H2N2O4

4-carboxy-1,2,5-oxadiazol-2-ium-2-olate

  • Molecular FormulaC3H2N2O4
  • Average mass130.059 Da
  • Monoisotopic mass130.001450 Da
  • ChemSpider ID14188271

More details:

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

1,2,5-Oxadiazol-3-carbonsäure-5-oxid [German] [ACD/IUPAC Name]
1,2,5-Oxadiazole-3-carboxylic acid 5-oxide [ACD/IUPAC Name]
1,2,5-Oxadiazole-3-carboxylic acid, 5-oxide [ACD/Index Name]
153309-86-5 [RN]
4-carboxy-1,2,5-oxadiazol-2-ium-2-olate
Acide 5-oxyde de -1,2,5-oxadiazole-3-carboxylique [French] [ACD/IUPAC Name]
4-Carboxy-1,2,5-oxadiazole 2-oxide

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

Density: 2.0±0.1 g/cm3
Boiling Point: 376.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 181.4±25.7 °C
Index of Refraction: 1.675
Molar Refractivity: 24.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.47
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 9.8±0.5 10-24cm3
Surface Tension: 94.3±7.0 dyne/cm
Molar Volume: 65.9±7.0 cm3

Click to predict properties on the Chemicalize site


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