ChemSpider 2D Image | 5-{5-[(E)-(Hydroxyimino)methyl]-1,2,4-oxadiazol-3-yl}-1,3,4-oxadiazol-2-amine | C5H4N6O3

5-{5-[(E)-(Hydroxyimino)methyl]-1,2,4-oxadiazol-3-yl}-1,3,4-oxadiazol-2-amine

  • Molecular FormulaC5H4N6O3
  • Average mass196.124 Da
  • Monoisotopic mass196.034485 Da
  • ChemSpider ID60762902

More details:

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

1,2,4-Oxadiazole-5-carboxaldehyde, 3-(5-amino-1,3,4-oxadiazol-2-yl)-, oxime [ACD/Index Name]
5-{5-[(E)-(Hydroxyimino)methyl]-1,2,4-oxadiazol-3-yl}-1,3,4-oxadiazol-2-amin [German] [ACD/IUPAC Name]
5-{5-[(E)-(Hydroxyimino)methyl]-1,2,4-oxadiazol-3-yl}-1,3,4-oxadiazol-2-amine [ACD/IUPAC Name]
5-{5-[(E)-(Hydroxyimino)méthyl]-1,2,4-oxadiazol-3-yl}-1,3,4-oxadiazol-2-amine [French] [ACD/IUPAC Name]
165066-63-7 [RN]
MFCD20717750

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

Density: 2.3±0.1 g/cm3
Boiling Point: 535.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 277.9±25.4 °C
Index of Refraction: 1.931
Molar Refractivity: 41.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.16
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.88
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.25
Polar Surface Area: 136 Å2
Polarizability: 16.4±0.5 10-24cm3
Surface Tension: 121.4±7.0 dyne/cm
Molar Volume: 86.7±7.0 cm3

Click to predict properties on the Chemicalize site


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