ChemSpider 2D Image | N-[4-(4-Methylphenyl)-2-oxo-6-[4-(4,4,4-trifluorobutoxy)phenyl]-6-(trifluoromethyl)-1,2,5,6-tetrahydro-3-pyridinyl]-1,3-oxazole-5-carboxamide | C27H23F6N3O4

N-[4-(4-Methylphenyl)-2-oxo-6-[4-(4,4,4-trifluorobutoxy)phenyl]-6-(trifluoromethyl)-1,2,5,6-tetrahydro-3-pyridinyl]-1,3-oxazole-5-carboxamide

  • Molecular FormulaC27H23F6N3O4
  • Average mass567.480 Da
  • Monoisotopic mass567.159302 Da
  • ChemSpider ID61748689

More details:

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

5-Oxazolecarboxamide, N-[1,2,5,6-tetrahydro-4-(4-methylphenyl)-2-oxo-6-[4-(4,4,4-trifluorobutoxy)phenyl]-6-(trifluoromethyl)-3-pyridinyl]- [ACD/Index Name]
N-[4-(4-Methylphenyl)-2-oxo-6-[4-(4,4,4-trifluorbutoxy)phenyl]-6-(trifluormethyl)-1,2,5,6-tetrahydro-3-pyridinyl]-1,3-oxazol-5-carboxamid [German] [ACD/IUPAC Name]
N-[4-(4-Methylphenyl)-2-oxo-6-[4-(4,4,4-trifluorobutoxy)phenyl]-6-(trifluoromethyl)-1,2,5,6-tetrahydro-3-pyridinyl]-1,3-oxazole-5-carboxamide [ACD/IUPAC Name]
N-[4-(4-Méthylphényl)-2-oxo-6-[4-(4,4,4-trifluorobutoxy)phényl]-6-(trifluorométhyl)-1,2,5,6-tétrahydro-3-pyridinyl]-1,3-oxazole-5-carboxamide [French] [ACD/IUPAC 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: 693.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 373.4±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 129.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 591.28
ACD/KOC (pH 5.5): 3354.65
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 590.59
ACD/KOC (pH 7.4): 3350.79
Polar Surface Area: 93 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 398.5±5.0 cm3

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