ChemSpider 2D Image | 6-Chloro-4-methoxy-2-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}quinoline | C19H11ClF3N3O3

6-Chloro-4-methoxy-2-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}quinoline

  • Molecular FormulaC19H11ClF3N3O3
  • Average mass421.757 Da
  • Monoisotopic mass421.044098 Da
  • ChemSpider ID75823751

More details:

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

6-Chlor-4-methoxy-2-{3-[4-(trifluormethoxy)phenyl]-1,2,4-oxadiazol-5-yl}chinolin [German] [ACD/IUPAC Name]
6-Chloro-4-méthoxy-2-{3-[4-(trifluorométhoxy)phényl]-1,2,4-oxadiazol-5-yl}quinoléine [French] [ACD/IUPAC Name]
6-Chloro-4-methoxy-2-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}quinoline [ACD/IUPAC Name]
Quinoline, 6-chloro-4-methoxy-2-[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]- [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: 511.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 263.3±32.9 °C
Index of Refraction: 1.588
Molar Refractivity: 98.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.79
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 7002.97
ACD/KOC (pH 5.5): 19680.84
ACD/LogD (pH 7.4): 5.36
ACD/BCF (pH 7.4): 7003.00
ACD/KOC (pH 7.4): 19680.92
Polar Surface Area: 70 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 292.9±3.0 cm3

Click to predict properties on the Chemicalize site


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