ChemSpider 2D Image | 2-(2-Thienyl)-5-{[4-(trifluoromethoxy)benzyl]sulfanyl}-1,3,4-oxadiazole | C14H9F3N2O2S2

2-(2-Thienyl)-5-{[4-(trifluoromethoxy)benzyl]sulfanyl}-1,3,4-oxadiazole

  • Molecular FormulaC14H9F3N2O2S2
  • Average mass358.359 Da
  • Monoisotopic mass358.005737 Da
  • ChemSpider ID31428293

More details:

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

1,3,4-Oxadiazole, 2-(2-thienyl)-5-[[[4-(trifluoromethoxy)phenyl]methyl]thio]- [ACD/Index Name]
2-(2-Thienyl)-5-{[4-(trifluormethoxy)benzyl]sulfanyl}-1,3,4-oxadiazol [German] [ACD/IUPAC Name]
2-(2-Thienyl)-5-{[4-(trifluoromethoxy)benzyl]sulfanyl}-1,3,4-oxadiazole [ACD/IUPAC Name]
2-(2-Thiényl)-5-{[4-(trifluorométhoxy)benzyl]sulfanyl}-1,3,4-oxadiazole [French] [ACD/IUPAC 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: 442.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 221.3±31.5 °C
Index of Refraction: 1.610
Molar Refractivity: 81.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 835.31
ACD/KOC (pH 5.5): 4295.94
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 835.31
ACD/KOC (pH 7.4): 4295.94
Polar Surface Area: 102 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 59.5±5.0 dyne/cm
Molar Volume: 236.0±5.0 cm3

Click to predict properties on the Chemicalize site


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