ChemSpider 2D Image | (3-{[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperidinyl)[2-(trifluoromethyl)phenyl]methanone | C22H19F4N3O2

(3-{[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperidinyl)[2-(trifluoromethyl)phenyl]methanone

  • Molecular FormulaC22H19F4N3O2
  • Average mass433.399 Da
  • Monoisotopic mass433.141327 Da
  • ChemSpider ID32692405

More details:

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

(3-{[3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperidinyl)[2-(trifluoromethyl)phenyl]methanone [ACD/IUPAC Name]
(3-{[3-(2-Fluorophényl)-1,2,4-oxadiazol-5-yl]méthyl}-1-pipéridinyl)[2-(trifluorométhyl)phényl]méthanone [French] [ACD/IUPAC Name]
(3-{[3-(2-Fluorphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-piperidinyl)[2-(trifluormethyl)phenyl]methanon [German] [ACD/IUPAC Name]
Methanone, [3-[[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperidinyl][2-(trifluoromethyl)phenyl]- [ACD/Index Name]
(3-((3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl)methyl)piperidin-1-yl)(2-(trifluoromethyl)phenyl)methanone
1706099-91-3 [RN]
3-{[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-[2-(trifluoromethyl)benzoyl]piperidine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 560.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.3±3.0 kJ/mol
Flash Point: 292.5±32.9 °C
Index of Refraction: 1.550
Molar Refractivity: 103.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 822.83
ACD/KOC (pH 5.5): 4249.92
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 822.83
ACD/KOC (pH 7.4): 4249.92
Polar Surface Area: 59 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 325.1±3.0 cm3

Click to predict properties on the Chemicalize site


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