ChemSpider 2D Image | 7-(Methylidene)-8-((p-toluenesulfonato)amino)-1-(trimethylsily)-8-azabicyclo(3.2.1)octane | C18H28N2O2SSi

7-(Methylidene)-8-((p-toluenesulfonato)amino)-1-(trimethylsily)-8-azabicyclo(3.2.1)octane

  • Molecular FormulaC18H28N2O2SSi
  • Average mass364.578 Da
  • Monoisotopic mass364.164063 Da
  • ChemSpider ID24590848

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-Methyl-N-[(1S,5S)-7-methylen-1-(trimethylsilyl)-8-azabicyclo[3.2.1]oct-8-yl]benzolsulfonamid [German] [ACD/IUPAC Name]
4-Methyl-N-[(1S,5S)-7-methylene-1-(trimethylsilyl)-8-azabicyclo[3.2.1]oct-8-yl]benzenesulfonamide [ACD/IUPAC Name]
4-Méthyl-N-[(1S,5S)-7-méthylène-1-(triméthylsilyl)-8-azabicyclo[3.2.1]oct-8-yl]benzènesulfonamide [French] [ACD/IUPAC Name]
7-(Methylidene)-8-((p-toluenesulfonato)amino)-1-(trimethylsily)-8-azabicyclo(3.2.1)octane
Benzenesulfonamide, 4-methyl-N-[(1S,5S)-7-methylene-1-(trimethylsilyl)-8-azabicyclo[3.2.1]oct-8-yl]- [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: 450.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 226.4±31.5 °C
Index of Refraction: 1.569
Molar Refractivity: 102.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 639.83
ACD/KOC (pH 5.5): 3549.21
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 631.71
ACD/KOC (pH 7.4): 3504.16
Polar Surface Area: 58 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 41.8±5.0 dyne/cm
Molar Volume: 313.8±5.0 cm3

Click to predict properties on the Chemicalize site


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