ChemSpider 2D Image | 3-(Isobutylsulfonyl)-1-[(2-methoxyphenyl)sulfonyl]azetidine | C14H21NO5S2

3-(Isobutylsulfonyl)-1-[(2-methoxyphenyl)sulfonyl]azetidine

  • Molecular FormulaC14H21NO5S2
  • Average mass347.450 Da
  • Monoisotopic mass347.086121 Da
  • ChemSpider ID30764225

More details:






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

3-(Isobutylsulfonyl)-1-[(2-methoxyphenyl)sulfonyl]azetidin [German] [ACD/IUPAC Name]
3-(Isobutylsulfonyl)-1-[(2-methoxyphenyl)sulfonyl]azetidine [ACD/IUPAC Name]
3-(Isobutylsulfonyl)-1-[(2-méthoxyphényl)sulfonyl]azétidine [French] [ACD/IUPAC Name]
Azetidine, 1-[(2-methoxyphenyl)sulfonyl]-3-[(2-methylpropyl)sulfonyl]- [ACD/Index Name]
1797087-29-6 [RN]
3-(isobutylsulfonyl)-1-((2-methoxyphenyl)sulfonyl)azetidine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 554.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.6±3.0 kJ/mol
Flash Point: 289.2±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 85.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.57
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.19
ACD/KOC (pH 5.5): 142.87
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.19
ACD/KOC (pH 7.4): 142.87
Polar Surface Area: 98 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 255.1±5.0 cm3

Click to predict properties on the Chemicalize site






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