ChemSpider 2D Image | 2-(4-Fluorophenoxy)-1-(3-{3-[2-(tetrahydro-2H-pyran-4-ylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)ethanone | C21H26FN3O5

2-(4-Fluorophenoxy)-1-(3-{3-[2-(tetrahydro-2H-pyran-4-ylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)ethanone

  • Molecular FormulaC21H26FN3O5
  • Average mass419.447 Da
  • Monoisotopic mass419.185638 Da
  • ChemSpider ID53599524

More details:

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

2-(4-Fluorophenoxy)-1-(3-{3-[2-(tetrahydro-2H-pyran-4-ylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)ethanone [ACD/IUPAC Name]
2-(4-Fluorophénoxy)-1-(3-{3-[2-(tétrahydro-2H-pyran-4-ylméthoxy)éthyl]-1,2,4-oxadiazol-5-yl}-1-azétidinyl)éthanone [French] [ACD/IUPAC Name]
2-(4-Fluorphenoxy)-1-(3-{3-[2-(tetrahydro-2H-pyran-4-ylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-(4-fluorophenoxy)-1-[3-[3-[2-[(tetrahydro-2H-pyran-4-yl)methoxy]ethyl]-1,2,4-oxadiazol-5-yl]-1-azetidinyl]- [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: 625.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.2±34.3 °C
Index of Refraction: 1.548
Molar Refractivity: 104.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.75
ACD/KOC (pH 5.5): 177.63
ACD/LogD (pH 7.4): 1.60
ACD/BCF (pH 7.4): 9.75
ACD/KOC (pH 7.4): 177.63
Polar Surface Area: 87 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 328.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement