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Search term: DQWNTGMOUIJOAL-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | {1,3-Dimethyl-5-[2-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl}[2-(3-pyridinyl)-1-piperidinyl]methanone | C23H23F3N4O2

{1,3-Dimethyl-5-[2-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl}[2-(3-pyridinyl)-1-piperidinyl]methanone

  • Molecular FormulaC23H23F3N4O2
  • Average mass444.449 Da
  • Monoisotopic mass444.177307 Da
  • ChemSpider ID29414947

More details:

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

{1,3-Dimethyl-5-[2-(trifluormethyl)phenoxy]-1H-pyrazol-4-yl}[2-(3-pyridinyl)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
{1,3-Dimethyl-5-[2-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl}[2-(3-pyridinyl)-1-piperidinyl]methanone [ACD/IUPAC Name]
{1,3-Diméthyl-5-[2-(trifluorométhyl)phénoxy]-1H-pyrazol-4-yl}[2-(3-pyridinyl)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [1,3-dimethyl-5-[2-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl][2-(3-pyridinyl)-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 561.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.5±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 114.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 199.56
ACD/KOC (pH 5.5): 1271.72
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 388.10
ACD/KOC (pH 7.4): 2473.25
Polar Surface Area: 60 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 335.6±7.0 cm3

Click to predict properties on the Chemicalize site


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