ChemSpider 2D Image | 4-[4-(Difluoromethoxy)benzylidene]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]-1,3-oxazol-5(4H)-one | C21H16F2N2O4

4-[4-(Difluoromethoxy)benzylidene]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]-1,3-oxazol-5(4H)-one

  • Molecular FormulaC21H16F2N2O4
  • Average mass398.359 Da
  • Monoisotopic mass398.107819 Da
  • ChemSpider ID35462537

More details:

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

4-[4-(Difluormethoxy)benzyliden]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]-1,3-oxazol-5(4H)-on [German] [ACD/IUPAC Name]
4-[4-(Difluoromethoxy)benzylidene]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]-1,3-oxazol-5(4H)-one [ACD/IUPAC Name]
4-[4-(Difluorométhoxy)benzylidène]-2-[4-(2-oxo-1-pyrrolidinyl)phényl]-1,3-oxazol-5(4H)-one [French] [ACD/IUPAC Name]
5(4H)-Oxazolone, 4-[[4-(difluoromethoxy)phenyl]methylene]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 611.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.4±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 100.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 94.18
ACD/KOC (pH 5.5): 900.69
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 94.18
ACD/KOC (pH 7.4): 900.70
Polar Surface Area: 68 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 47.8±7.0 dyne/cm
Molar Volume: 285.3±7.0 cm3

Click to predict properties on the Chemicalize site


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