ChemSpider 2D Image | 2-Cyclohexyl-5-{[3-(2,2,2-trifluoroethoxy)propyl]sulfanyl}-1,3,4-oxadiazole | C13H19F3N2O2S

2-Cyclohexyl-5-{[3-(2,2,2-trifluoroethoxy)propyl]sulfanyl}-1,3,4-oxadiazole

  • Molecular FormulaC13H19F3N2O2S
  • Average mass324.362 Da
  • Monoisotopic mass324.111938 Da
  • ChemSpider ID62255962

More details:

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

1,3,4-Oxadiazole, 2-cyclohexyl-5-[[3-(2,2,2-trifluoroethoxy)propyl]thio]- [ACD/Index Name]
2-Cyclohexyl-5-{[3-(2,2,2-trifluorethoxy)propyl]sulfanyl}-1,3,4-oxadiazol [German] [ACD/IUPAC Name]
2-Cyclohexyl-5-{[3-(2,2,2-trifluoroethoxy)propyl]sulfanyl}-1,3,4-oxadiazole [ACD/IUPAC Name]
2-Cyclohexyl-5-{[3-(2,2,2-trifluoroéthoxy)propyl]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: 1.3±0.1 g/cm3
Boiling Point: 402.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 197.1±31.5 °C
Index of Refraction: 1.489
Molar Refractivity: 73.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.03
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 216.97
ACD/KOC (pH 5.5): 1636.84
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 216.97
ACD/KOC (pH 7.4): 1636.84
Polar Surface Area: 73 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 42.8±5.0 dyne/cm
Molar Volume: 255.7±5.0 cm3

Click to predict properties on the Chemicalize site


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