ChemSpider 2D Image | Methyl {[3-(isobutylsulfonyl)-1-azetidinyl]sulfonyl}acetate | C10H19NO6S2

Methyl {[3-(isobutylsulfonyl)-1-azetidinyl]sulfonyl}acetate

  • Molecular FormulaC10H19NO6S2
  • Average mass313.391 Da
  • Monoisotopic mass313.065369 Da
  • ChemSpider ID30764245

More details:

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

{[3-(Isobutylsulfonyl)-1-azétidinyl]sulfonyl}acétate de méthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[3-[(2-methylpropyl)sulfonyl]-1-azetidinyl]sulfonyl]-, methyl ester [ACD/Index Name]
Methyl {[3-(isobutylsulfonyl)-1-azetidinyl]sulfonyl}acetate [ACD/IUPAC Name]
Methyl-{[3-(isobutylsulfonyl)-1-azetidinyl]sulfonyl}acetat [German] [ACD/IUPAC Name]
1797886-44-2 [RN]
methyl 2-((3-(isobutylsulfonyl)azetidin-1-yl)sulfonyl)acetate
methyl 2-{[3-(2-methylpropanesulfonyl)azetidin-1-yl]sulfonyl}acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 501.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 257.1±32.9 °C
Index of Refraction: 1.529
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.10
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.80
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.80
Polar Surface Area: 115 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 52.7±5.0 dyne/cm
Molar Volume: 225.7±5.0 cm3

Click to predict properties on the Chemicalize site


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