ChemSpider 2D Image | 1-{1-[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(methylsulfonyl)piperazine | C13H24N4O3S

1-{1-[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(methylsulfonyl)piperazine

  • Molecular FormulaC13H24N4O3S
  • Average mass316.420 Da
  • Monoisotopic mass316.156921 Da
  • ChemSpider ID22816990

More details:

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

1-{1-[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(methylsulfonyl)piperazin [German] [ACD/IUPAC Name]
1-{1-[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]ethyl}-4-(methylsulfonyl)piperazine [ACD/IUPAC Name]
1-{1-[3-(2-Méthyl-2-propanyl)-1,2,4-oxadiazol-5-yl]éthyl}-4-(méthylsulfonyl)pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[1-[3-(1,1-dimethylethyl)-1,2,4-oxadiazol-5-yl]ethyl]-4-(methylsulfonyl)- [ACD/Index 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: 444.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.5±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 80.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.98
ACD/KOC (pH 5.5): 139.83
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.98
ACD/KOC (pH 7.4): 139.88
Polar Surface Area: 88 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 252.8±5.0 cm3

Click to predict properties on the Chemicalize site


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