ChemSpider 2D Image | 4-Methyldihydro-3(2H)-thiophenone | C5H8OS

4-Methyldihydro-3(2H)-thiophenone

  • Molecular FormulaC5H8OS
  • Average mass116.181 Da
  • Monoisotopic mass116.029587 Da
  • ChemSpider ID14452237

More details:

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

3(2H)-Thiophenone, dihydro-4-methyl- [ACD/Index Name]
4-Methyldihydro-3(2H)-thiophenon [German] [ACD/IUPAC Name]
4-Methyldihydro-3(2H)-thiophenone [ACD/IUPAC Name]
4-Méthyldihydro-3(2H)-thiophénone [French] [ACD/IUPAC Name]
4-Methyldihydrothiophen-3(2H)-one
50565-25-8 [RN]
Dihydro-4-methyl-3(2H)-thiophenone
[50565-25-8] [RN]
2-AMINO-1-(2-NAPHTHYL)-1-ETHANOL;2-(2-Amino-1-hydroxyethyl)naphthalene;2-Amino-1-(naphth-2-yl)ethan-1-ol
2-amino-1-(naphthalen-2-yl)ethanol
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 180.0±23.0 °C at 760 mmHg
    Vapour Pressure: 0.9±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.6±3.0 kJ/mol
    Flash Point: 72.1±8.3 °C
    Index of Refraction: 1.513
    Molar Refractivity: 31.4±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.20
    ACD/LogD (pH 5.5): 0.70
    ACD/BCF (pH 5.5): 2.00
    ACD/KOC (pH 5.5): 57.05
    ACD/LogD (pH 7.4): 0.70
    ACD/BCF (pH 7.4): 2.00
    ACD/KOC (pH 7.4): 57.05
    Polar Surface Area: 42 Å2
    Polarizability: 12.5±0.5 10-24cm3
    Surface Tension: 35.8±3.0 dyne/cm
    Molar Volume: 104.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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