ChemSpider 2D Image | 3-(1-Phenyl-1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]-4(1H)-pyridazinone | C20H13F3N4O

3-(1-Phenyl-1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]-4(1H)-pyridazinone

  • Molecular FormulaC20H13F3N4O
  • Average mass382.339 Da
  • Monoisotopic mass382.104156 Da
  • ChemSpider ID35035201

More details:

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

3-(1-Phenyl-1H-pyrazol-5-yl)-1-[3-(trifluormethyl)phenyl]-4(1H)-pyridazinon [German] [ACD/IUPAC Name]
3-(1-Phenyl-1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]-4(1H)-pyridazinone [ACD/IUPAC Name]
3-(1-Phényl-1H-pyrazol-5-yl)-1-[3-(trifluorométhyl)phényl]-4(1H)-pyridazinone [French] [ACD/IUPAC Name]
3-(1-Phenyl-1h-Pyrazol-5-Yl)-1-[3-(Trifluoromethyl)phenyl]pyridazin-4(1h)-One
4(1H)-Pyridazinone, 3-(1-phenyl-1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
3KG

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

Density: 1.4±0.1 g/cm3
Boiling Point: 506.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 260.1±32.9 °C
Index of Refraction: 1.622
Molar Refractivity: 99.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 404.20
ACD/KOC (pH 5.5): 2555.07
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 404.20
ACD/KOC (pH 7.4): 2555.07
Polar Surface Area: 50 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 46.0±7.0 dyne/cm
Molar Volume: 282.7±7.0 cm3

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