ChemSpider 2D Image | 1-(Methylsulfonyl)-2,5-dihydro-1H-pyrrole | C5H9NO2S

1-(Methylsulfonyl)-2,5-dihydro-1H-pyrrole

  • Molecular FormulaC5H9NO2S
  • Average mass147.195 Da
  • Monoisotopic mass147.035400 Da
  • ChemSpider ID26577333

More details:

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

1-(Methylsulfonyl)-2,5-dihydro-1H-pyrrol [German] [ACD/IUPAC Name]
1-(Methylsulfonyl)-2,5-dihydro-1H-pyrrole [ACD/IUPAC Name]
1-(Méthylsulfonyl)-2,5-dihydro-1H-pyrrole [French] [ACD/IUPAC Name]
1H-Pyrrole, 2,5-dihydro-1-(methylsulfonyl)- [ACD/Index Name]
246540-50-1 [RN]
"1-(Methylsulfonyl)-2,5-dihydro-1H-pyrrole"
(2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanol
[246540-50-1] [RN]
1-(Methanesulfonyl)-2,5-dihydro-1H-pyrrole
1-(Methylsulfonyl)-3-pyrroline
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 239.5±43.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.6±3.0 kJ/mol
    Flash Point: 98.6±28.2 °C
    Index of Refraction: 1.548
    Molar Refractivity: 35.8±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.08
    ACD/LogD (pH 5.5): 0.00
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 23.70
    ACD/LogD (pH 7.4): 0.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 23.70
    Polar Surface Area: 46 Å2
    Polarizability: 14.2±0.5 10-24cm3
    Surface Tension: 46.6±5.0 dyne/cm
    Molar Volume: 112.6±5.0 cm3

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