ChemSpider 2D Image | 6-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-8(5H)-one | C6H3F3N4O

6-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-8(5H)-one

  • Molecular FormulaC6H3F3N4O
  • Average mass204.109 Da
  • Monoisotopic mass204.025894 Da
  • ChemSpider ID37548803

More details:

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

1,2,4-Triazolo[4,3-b]pyridazin-8(5H)-one, 6-(trifluoromethyl)- [ACD/Index Name]
6-(Trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-8(5H)-on [German] [ACD/IUPAC Name]
6-(Trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-8(5H)-one [ACD/IUPAC Name]
6-(Trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-8(5H)-one [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 325.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 150.8±30.7 °C
Index of Refraction: 1.643
Molar Refractivity: 39.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.16
ACD/LogD (pH 5.5): 0.47
ACD/BCF (pH 5.5): 1.33
ACD/KOC (pH 5.5): 42.71
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 42.71
Polar Surface Area: 60 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 51.8±7.0 dyne/cm
Molar Volume: 108.5±7.0 cm3

Click to predict properties on the Chemicalize site


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