ChemSpider 2D Image | 2-Pyridinyl(3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)methanone | C18H13F3N4O2

2-Pyridinyl(3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)methanone

  • Molecular FormulaC18H13F3N4O2
  • Average mass374.317 Da
  • Monoisotopic mass374.099060 Da
  • ChemSpider ID30743360

More details:

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

2-Pyridinyl(3-{3-[3-(trifluormethyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)methanon [German] [ACD/IUPAC Name]
2-Pyridinyl(3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-azetidinyl)methanone [ACD/IUPAC Name]
2-Pyridinyl(3-{3-[3-(trifluorométhyl)phényl]-1,2,4-oxadiazol-5-yl}-1-azétidinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, 2-pyridinyl[3-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]-1-azetidinyl]- [ACD/Index Name]
1428347-91-4 [RN]
2-(3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}azetidine-1-carbonyl)pyridine
pyridin-2-yl(3-(3-(3-(trifluoromethyl)phenyl)-1,2,4-oxadiazol-5-yl)azetidin-1-yl)methanone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 538.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.6±3.0 kJ/mol
Flash Point: 279.6±32.9 °C
Index of Refraction: 1.577
Molar Refractivity: 87.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.75
ACD/KOC (pH 5.5): 485.56
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.80
ACD/KOC (pH 7.4): 486.22
Polar Surface Area: 72 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 264.5±3.0 cm3

Click to predict properties on the Chemicalize site


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