ChemSpider 2D Image | 4-(Methylsulfonyl)cyclohexanone | C7H12O3S

4-(Methylsulfonyl)cyclohexanone

  • Molecular FormulaC7H12O3S
  • Average mass176.233 Da
  • Monoisotopic mass176.050720 Da
  • ChemSpider ID32862755

More details:

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

4-(Methylsulfonyl)cyclohexanon [German] [ACD/IUPAC Name]
4-(Methylsulfonyl)cyclohexanone [ACD/IUPAC Name]
4-(Méthylsulfonyl)cyclohexanone [French] [ACD/IUPAC Name]
862129-72-4 [RN]
Cyclohexanone, 4-(methylsulfonyl)- [ACD/Index Name]
[862129-72-4] [RN]
4-(methylsulfonyl)cyclohexan-1-one
4-METHANESULFONYLCYCLOHEXAN-1-ONE
4-methanesulfonyl-cyclohexanone
4-methanesulfonyl-cyclohexanone???ws204647???
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 377.5±31.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.5±3.0 kJ/mol
    Flash Point: 241.9±17.5 °C
    Index of Refraction: 1.488
    Molar Refractivity: 41.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -1.00
    ACD/LogD (pH 5.5): -0.38
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 14.74
    ACD/LogD (pH 7.4): -0.38
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 14.74
    Polar Surface Area: 60 Å2
    Polarizability: 16.4±0.5 10-24cm3
    Surface Tension: 41.2±5.0 dyne/cm
    Molar Volume: 143.5±5.0 cm3

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