ChemSpider 2D Image | 4-Amino-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylene]-1,2,5-oxadiazole-3-carbohydrazonamide | C11H12N6O3

4-Amino-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylene]-1,2,5-oxadiazole-3-carbohydrazonamide

  • Molecular FormulaC11H12N6O3
  • Average mass276.251 Da
  • Monoisotopic mass276.097076 Da
  • ChemSpider ID21211715
  • Double-bond stereo - Double-bond stereo


More details:






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

1,2,5-Oxadiazole-3-carbohydrazonamide, 4-amino-N'-[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]- [ACD/Index Name]
4-Amino-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylen]-1,2,5-oxadiazol-3-carbohydrazonamid [German] [ACD/IUPAC Name]
4-Amino-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylene]-1,2,5-oxadiazole-3-carbohydrazonamide [ACD/IUPAC Name]
4-Amino-N'-[(E)-(2-hydroxy-3-méthoxyphényl)méthylène]-1,2,5-oxadiazole-3-carbohydrazonamide [French] [ACD/IUPAC Name]
4-amino-N'-(2-hydroxy-3-methoxybenzylidene)-1,2,5-oxadiazole-3-carbohydrazonamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 528.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 273.6±32.9 °C
Index of Refraction: 1.702
Molar Refractivity: 67.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 2.70
ACD/KOC (pH 5.5): 47.04
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 6.04
ACD/KOC (pH 7.4): 105.43
Polar Surface Area: 145 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 67.0±7.0 dyne/cm
Molar Volume: 174.5±7.0 cm3

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