ChemSpider 2D Image | 1-(2-Chlorobenzyl)-6-(2-furyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine | C19H13ClF3N3O

1-(2-Chlorobenzyl)-6-(2-furyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

  • Molecular FormulaC19H13ClF3N3O
  • Average mass391.774 Da
  • Monoisotopic mass391.069916 Da
  • ChemSpider ID21760401

More details:

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

1-(2-Chlorbenzyl)-6-(2-furyl)-3-methyl-4-(trifluormethyl)-1H-pyrazolo[3,4-b]pyridin [German] [ACD/IUPAC Name]
1-(2-Chlorobenzyl)-6-(2-furyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine [ACD/IUPAC Name]
1-(2-Chlorobenzyl)-6-(2-furyl)-3-méthyl-4-(trifluorométhyl)-1H-pyrazolo[3,4-b]pyridine [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-b]pyridine, 1-[(2-chlorophenyl)methyl]-6-(2-furanyl)-3-methyl-4-(trifluoromethyl)- [ACD/Index Name]
1-(2-chlorobenzyl)-6-(furan-2-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
1-(2-Chloro-benzyl)-6-furan-2-yl-3-methyl-4-trifluoromethyl-1H-pyrazolo[3,4-b]pyridine
2-{1-[(2-chlorophenyl)methyl]-3-methyl-4-(trifluoromethyl)pyrazolo[4,5-e]pyridin-6-yl}furan

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

Density: 1.4±0.1 g/cm3
Boiling Point: 523.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.8±3.0 kJ/mol
Flash Point: 270.6±30.1 °C
Index of Refraction: 1.619
Molar Refractivity: 95.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5796.38
ACD/KOC (pH 5.5): 17189.33
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5796.41
ACD/KOC (pH 7.4): 17189.43
Polar Surface Area: 44 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 42.5±7.0 dyne/cm
Molar Volume: 273.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement