ChemSpider 2D Image | 1-Methyl-4-[(1-vinylcyclopropyl)sulfonyl]benzene | C12H14O2S

1-Methyl-4-[(1-vinylcyclopropyl)sulfonyl]benzene

  • Molecular FormulaC12H14O2S
  • Average mass222.303 Da
  • Monoisotopic mass222.071457 Da
  • ChemSpider ID26600811

More details:






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

1-Methyl-4-[(1-vinylcyclopropyl)sulfonyl]benzene [ACD/IUPAC Name]
1-Méthyl-4-[(1-vinylcyclopropyl)sulfonyl]benzène [French] [ACD/IUPAC Name]
1-Methyl-4-[(1-vinylcyclopropyl)sulfonyl]benzol [German] [ACD/IUPAC Name]
Benzene, 1-[(1-ethenylcyclopropyl)sulfonyl]-4-methyl- [ACD/Index Name]
1-(1-ethenylcyclopropyl)sulfonyl-4-methylbenzene
4-methylphenyl 1-vinylcyclopropyl sulfone
84603-02-1 [RN]
AG-343/00736036
AGN-PC-00KRY9
MCULE-8140685630
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 361.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.3±3.0 kJ/mol
    Flash Point: 204.9±18.6 °C
    Index of Refraction: 1.610
    Molar Refractivity: 61.1±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.09
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.12
    ACD/KOC (pH 5.5): 417.00
    ACD/LogD (pH 7.4): 2.29
    ACD/BCF (pH 7.4): 32.12
    ACD/KOC (pH 7.4): 417.00
    Polar Surface Area: 43 Å2
    Polarizability: 24.2±0.5 10-24cm3
    Surface Tension: 54.3±3.0 dyne/cm
    Molar Volume: 176.1±3.0 cm3

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