ChemSpider 2D Image | 1-[(4-Ethoxy-3-methylphenyl)sulfonyl]-3-(methylsulfonyl)pyrrolidine | C14H21NO5S2

1-[(4-Ethoxy-3-methylphenyl)sulfonyl]-3-(methylsulfonyl)pyrrolidine

  • Molecular FormulaC14H21NO5S2
  • Average mass347.450 Da
  • Monoisotopic mass347.086121 Da
  • ChemSpider ID30758880

More details:






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

1-[(4-Ethoxy-3-methylphenyl)sulfonyl]-3-(methylsulfonyl)pyrrolidin [German] [ACD/IUPAC Name]
1-[(4-Ethoxy-3-methylphenyl)sulfonyl]-3-(methylsulfonyl)pyrrolidine [ACD/IUPAC Name]
1-[(4-Éthoxy-3-méthylphényl)sulfonyl]-3-(méthylsulfonyl)pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 1-[(4-ethoxy-3-methylphenyl)sulfonyl]-3-(methylsulfonyl)- [ACD/Index Name]
1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-(methylsulfonyl)pyrrolidine
1-(4-ETHOXY-3-METHYLBENZENESULFONYL)-3-METHANESULFONYLPYRROLIDINE
1448056-92-5 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 557.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 291.0±32.9 °C
Index of Refraction: 1.584
Molar Refractivity: 85.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.40
ACD/KOC (pH 5.5): 131.43
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.40
ACD/KOC (pH 7.4): 131.43
Polar Surface Area: 98 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 56.1±5.0 dyne/cm
Molar Volume: 254.0±5.0 cm3

Click to predict properties on the Chemicalize site






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