ChemSpider 2D Image | 1-[(Methylsulfonyl)methyl]cyclopropanecarbothioamide | C6H11NO2S2

1-[(Methylsulfonyl)methyl]cyclopropanecarbothioamide

  • Molecular FormulaC6H11NO2S2
  • Average mass193.287 Da
  • Monoisotopic mass193.023117 Da
  • ChemSpider ID35499903

More details:

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

1-[(Methylsulfonyl)methyl]cyclopropancarbothioamid [German] [ACD/IUPAC Name]
1-[(Methylsulfonyl)methyl]cyclopropanecarbothioamide [ACD/IUPAC Name]
1-[(Méthylsulfonyl)méthyl]cyclopropanecarbothioamide [French] [ACD/IUPAC Name]
Cyclopropanecarbothioamide, 1-[(methylsulfonyl)methyl]- [ACD/Index Name]
1-(methylsulfonylmethyl)cyclopropane-1-carbothioamide
1708269-13-9 [RN]
1-Methanesulfonylmethyl-cyclopropanecarbothioic acid amide
MFCD27975085

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 405.2±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.7±3.0 kJ/mol
    Flash Point: 198.8±26.5 °C
    Index of Refraction: 1.610
    Molar Refractivity: 47.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.23
    ACD/LogD (pH 5.5): -0.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.24
    ACD/LogD (pH 7.4): -0.60
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 11.24
    Polar Surface Area: 101 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 68.6±3.0 dyne/cm
    Molar Volume: 136.6±3.0 cm3

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