ChemSpider 2D Image | 3-Chloro-8-[(2,2-dimethylpropyl)sulfonyl]-8-azabicyclo[3.2.1]octane | C12H22ClNO2S

3-Chloro-8-[(2,2-dimethylpropyl)sulfonyl]-8-azabicyclo[3.2.1]octane

  • Molecular FormulaC12H22ClNO2S
  • Average mass279.827 Da
  • Monoisotopic mass279.105988 Da
  • ChemSpider ID46243118

More details:

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

3-Chlor-8-[(2,2-dimethylpropyl)sulfonyl]-8-azabicyclo[3.2.1]octan [German] [ACD/IUPAC Name]
3-Chloro-8-[(2,2-dimethylpropyl)sulfonyl]-8-azabicyclo[3.2.1]octane [ACD/IUPAC Name]
3-Chloro-8-[(2,2-diméthylpropyl)sulfonyl]-8-azabicyclo[3.2.1]octane [French] [ACD/IUPAC Name]
8-Azabicyclo[3.2.1]octane, 3-chloro-8-[(2,2-dimethylpropyl)sulfonyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 385.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.4±3.0 kJ/mol
Flash Point: 187.0±30.7 °C
Index of Refraction: 1.531
Molar Refractivity: 71.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 85.59
ACD/KOC (pH 5.5): 841.10
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 85.59
ACD/KOC (pH 7.4): 841.10
Polar Surface Area: 46 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 42.9±5.0 dyne/cm
Molar Volume: 229.3±5.0 cm3

Click to predict properties on the Chemicalize site


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