Found 213 results

Search term: MF = 'C_{9}H_{8}OS'
ChemSpider 2D Image | 5-methyl-2,3-dihydro-1-benzothiophen-3-one | C9H8OS

5-methyl-2,3-dihydro-1-benzothiophen-3-one

  • Molecular FormulaC9H8OS
  • Average mass164.224 Da
  • Monoisotopic mass164.029587 Da
  • ChemSpider ID27261074

More details:

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

56639-88-4 [RN]
5-methyl-2,3-dihydro-1-benzothiophen-3-one
2,3-dihydro-3-keto-5-methylbenzothiophene
5-Methyl-1-benzothiophen-3(2H)-on [German] [ACD/IUPAC Name]
5-Methyl-1-benzothiophen-3(2H)-one [ACD/IUPAC Name]
5-Méthyl-1-benzothiophén-3(2H)-one [French] [ACD/IUPAC Name]
5-methyl-1-benzothiophen-3-one
5-METHYL-2H-1-BENZOTHIOPHEN-3-ONE
5-methylbenzo[b]thiophen-3(2H)-one
AKOS022713898
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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: 307.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.8±3.0 kJ/mol
    Flash Point: 166.5±13.6 °C
    Index of Refraction: 1.637
    Molar Refractivity: 46.9±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.28
    ACD/LogD (pH 5.5): 2.28
    ACD/BCF (pH 5.5): 31.59
    ACD/KOC (pH 5.5): 412.08
    ACD/LogD (pH 7.4): 2.28
    ACD/BCF (pH 7.4): 31.59
    ACD/KOC (pH 7.4): 412.08
    Polar Surface Area: 42 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 50.3±3.0 dyne/cm
    Molar Volume: 130.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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