ChemSpider 2D Image | (3S)-3-methanesulfonylpyrrolidine | C5H11NO2S

(3S)-3-methanesulfonylpyrrolidine

  • Molecular FormulaC5H11NO2S
  • Average mass149.211 Da
  • Monoisotopic mass149.051056 Da
  • ChemSpider ID24723313

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(Methylsulfonyl)pyrrolidin [German] [ACD/IUPAC Name]
(3S)-3-(Methylsulfonyl)pyrrolidine [ACD/IUPAC Name]
(3S)-3-(Méthylsulfonyl)pyrrolidine [French] [ACD/IUPAC Name]
(3S)-3-methanesulfonylpyrrolidine
290328-57-3 [RN]
Pyrrolidine, 3-(methylsulfonyl)-, (3S)- [ACD/Index Name]
(3S)-3-(Methanesulfonyl)pyrrolidine
(3S)-3-Methylsulfonylpyrrolidine
(S)-3-(Methylsulfonyl)pyrrolidine
1407997-84-5 [RN]
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 326.9±31.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.9±3.0 kJ/mol
    Flash Point: 151.5±24.8 °C
    Index of Refraction: 1.500
    Molar Refractivity: 35.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -1.55
    ACD/LogD (pH 5.5): -3.86
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 55 Å2
    Polarizability: 14.1±0.5 10-24cm3
    Surface Tension: 41.1±5.0 dyne/cm
    Molar Volume: 121.1±5.0 cm3

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