ChemSpider 2D Image | 5-(2-Thienylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptane | C9H11NO2S3

5-(2-Thienylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptane

  • Molecular FormulaC9H11NO2S3
  • Average mass261.384 Da
  • Monoisotopic mass260.995178 Da
  • ChemSpider ID58241320

More details:

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

2-Thia-5-azabicyclo[2.2.1]heptane, 5-(2-thienylsulfonyl)- [ACD/Index Name]
5-(2-Thienylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptan [German] [ACD/IUPAC Name]
5-(2-Thienylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptane [ACD/IUPAC Name]
5-(2-Thiénylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptane [French] [ACD/IUPAC Name]
5-(thiophen-2-ylsulfonyl)-2-thia-5-azabicyclo[2.2.1]heptane

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

Density: 1.5±0.1 g/cm3
Boiling Point: 438.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 218.9±31.5 °C
Index of Refraction: 1.673
Molar Refractivity: 64.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.42
ACD/KOC (pH 5.5): 269.11
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.42
ACD/KOC (pH 7.4): 269.11
Polar Surface Area: 99 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 62.1±3.0 dyne/cm
Molar Volume: 172.5±3.0 cm3

Click to predict properties on the Chemicalize site


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