ChemSpider 2D Image | 3-Amino-1,2,4-oxadiazole-5-carboxylic acid | C3H3N3O3

3-Amino-1,2,4-oxadiazole-5-carboxylic acid

  • Molecular FormulaC3H3N3O3
  • Average mass129.074 Da
  • Monoisotopic mass129.017441 Da
  • ChemSpider ID45653266

More details:

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

1,2,4-Oxadiazole-5-carboxylic acid, 3-amino- [ACD/Index Name]
3-Amino-1,2,4-oxadiazol-5-carbonsäure [German] [ACD/IUPAC Name]
3-Amino-1,2,4-oxadiazole-5-carboxylic acid [ACD/IUPAC Name]
Acide 3-amino-1,2,4-oxadiazole-5-carboxylique [French] [ACD/IUPAC Name]
1550821-86-7 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 420.3±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 208.0±24.0 °C
Index of Refraction: 1.623
Molar Refractivity: 25.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.26
ACD/LogD (pH 5.5): -3.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 10.3±0.5 10-24cm3
Surface Tension: 109.1±3.0 dyne/cm
Molar Volume: 73.5±3.0 cm3

Click to predict properties on the Chemicalize site


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