ChemSpider 2D Image | 1-[(3-Methylbutyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine | C13H24N4O3S

1-[(3-Methylbutyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine

  • Molecular FormulaC13H24N4O3S
  • Average mass316.420 Da
  • Monoisotopic mass316.156921 Da
  • ChemSpider ID30232242

More details:

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

1-[(3-Methylbutyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin [German] [ACD/IUPAC Name]
1-[(3-Methylbutyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine [ACD/IUPAC Name]
1-[(3-Méthylbutyl)sulfonyl]-4-[(5-méthyl-1,2,4-oxadiazol-3-yl)méthyl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[(3-methylbutyl)sulfonyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]- [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: 456.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 229.7±31.5 °C
Index of Refraction: 1.549
Molar Refractivity: 80.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 6.01
ACD/KOC (pH 5.5): 125.28
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 6.05
ACD/KOC (pH 7.4): 126.29
Polar Surface Area: 88 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 252.3±5.0 cm3

Click to predict properties on the Chemicalize site


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