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ChemSpider 2D Image | 8-(Trifluoromethyl)pyrazolo[5,1-c][1,2,4]benzotriazine 5-oxide | C10H5F3N4O

8-(Trifluoromethyl)pyrazolo[5,1-c][1,2,4]benzotriazine 5-oxide

  • Molecular FormulaC10H5F3N4O
  • Average mass254.168 Da
  • Monoisotopic mass254.041550 Da
  • ChemSpider ID62856632

More details:

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

5-Oxyde de 8-(trifluorométhyl)pyrazolo[5,1-c][1,2,4]benzotriazine [French] [ACD/IUPAC Name]
8-(Trifluormethyl)pyrazolo[5,1-c][1,2,4]benzotriazin-5-oxid [German] [ACD/IUPAC Name]
8-(Trifluoromethyl)pyrazolo[5,1-c][1,2,4]benzotriazine 5-oxide [ACD/IUPAC Name]
Pyrazolo[5,1-c][1,2,4]benzotriazine, 8-(trifluoromethyl)-, 5-oxide [ACD/Index Name]
1253428-22-6 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 236.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.4±3.0 kJ/mol
Flash Point: 97.1±30.1 °C
Index of Refraction: 1.667
Molar Refractivity: 56.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 24.40
ACD/KOC (pH 5.5): 307.67
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 35.38
ACD/KOC (pH 7.4): 446.22
Polar Surface Area: 56 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 150.5±7.0 cm3

Click to predict properties on the Chemicalize site


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