ChemSpider 2D Image | 3-(1-Methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-3-yl)phenyl]-1,2,4-oxadiazole | C14H11N7O

3-(1-Methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-3-yl)phenyl]-1,2,4-oxadiazole

  • Molecular FormulaC14H11N7O
  • Average mass293.283 Da
  • Monoisotopic mass293.102509 Da
  • ChemSpider ID22346466

More details:

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

1,2,4-Oxadiazole, 3-(1-methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-5-yl)phenyl]- [ACD/Index Name]
3-(1-Methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-3-yl)phenyl]-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
3-(1-Methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-3-yl)phenyl]-1,2,4-oxadiazole [ACD/IUPAC Name]
3-(1-Méthyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-3-yl)phényl]-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
3-(1-methyl-1H-imidazol-4-yl)-5-[4-(1H-1,2,4-triazol-5-yl)phenyl]-1,2,4-oxadiazole

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

Density: 1.6±0.1 g/cm3
Boiling Point: 639.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 340.8±34.3 °C
Index of Refraction: 1.796
Molar Refractivity: 80.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 13.54
ACD/KOC (pH 5.5): 224.63
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.11
ACD/KOC (pH 7.4): 217.63
Polar Surface Area: 98 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 67.2±7.0 dyne/cm
Molar Volume: 188.6±7.0 cm3

Click to predict properties on the Chemicalize site


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