ChemSpider 2D Image | 3-[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]-7-(trifluoromethyl)-4(1H)-quinolinone | C16H8F3N3O2S

3-[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]-7-(trifluoromethyl)-4(1H)-quinolinone

  • Molecular FormulaC16H8F3N3O2S
  • Average mass363.314 Da
  • Monoisotopic mass363.028931 Da
  • ChemSpider ID75820064

More details:

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

3-[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]-7-(trifluormethyl)-4(1H)-chinolinon [German] [ACD/IUPAC Name]
3-[3-(2-Thiényl)-1,2,4-oxadiazol-5-yl]-7-(trifluorométhyl)-4(1H)-quinoléinone [French] [ACD/IUPAC Name]
3-[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]-7-(trifluoromethyl)-4(1H)-quinolinone [ACD/IUPAC Name]
4(1H)-Quinolinone, 3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]-7-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 483.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.5±31.5 °C
Index of Refraction: 1.597
Molar Refractivity: 82.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 846.06
ACD/KOC (pH 5.5): 4335.46
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 846.06
ACD/KOC (pH 7.4): 4335.46
Polar Surface Area: 96 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 241.8±3.0 cm3

Click to predict properties on the Chemicalize site


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