ChemSpider 2D Image | 4-(Trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one | C14H7F6N3O

4-(Trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one

  • Molecular FormulaC14H7F6N3O
  • Average mass347.215 Da
  • Monoisotopic mass347.049316 Da
  • ChemSpider ID24808432

More details:

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

4-(Trifluormethyl)-3-[3-(trifluormethyl)phenyl]-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-on [German] [ACD/IUPAC Name]
4-(Trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one [ACD/IUPAC Name]
4-(Trifluorométhyl)-3-[3-(trifluorométhyl)phényl]-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one [French] [ACD/IUPAC Name]
6H-Pyrazolo[3,4-b]pyridin-6-one, 1,7-dihydro-4-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
1,7-DIHYDRO-4-(TRIFLUOROMETHYL)-3-[3-(TRIFLUOROMETHYL)PHENYL]-6H-PYRAZOLO-[3,4-B]PYRIDIN-6-ONE
1262406-08-5 [RN]
3NE
4-(trifluoromethyl)-3-(3-(trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridin-6(7H)-one
6H-Pyrazolo[3,4-b]pyridin-6-one,1,7-dihydro-4-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]-
Kinome_3305

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

Density: 1.6±0.1 g/cm3
Boiling Point: 480.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 244.6±28.7 °C
Index of Refraction: 1.524
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 215.44
ACD/KOC (pH 5.5): 1628.54
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 214.95
ACD/KOC (pH 7.4): 1624.85
Polar Surface Area: 58 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 223.5±3.0 cm3

Click to predict properties on the Chemicalize site


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