ChemSpider 2D Image | 6-(1-benzothiophen-2-yl)pyridin-2-ol | C13H9NOS

6-(1-benzothiophen-2-yl)pyridin-2-ol

  • Molecular FormulaC13H9NOS
  • Average mass227.282 Da
  • Monoisotopic mass227.040482 Da
  • ChemSpider ID28295415

More details:






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

1111105-57-7 [RN]
2(1H)-Pyridinone, 6-benzo[b]thien-2-yl- [ACD/Index Name]
6-(1-Benzothiophen-2-yl)-2(1H)-pyridinon [German] [ACD/IUPAC Name]
6-(1-Benzothiophen-2-yl)-2(1H)-pyridinone [ACD/IUPAC Name]
6-(1-Benzothiophén-2-yl)-2(1H)-pyridinone [French] [ACD/IUPAC Name]
6-(1-benzothiophen-2-yl)pyridin-2-ol
[1111105-57-7] [RN]
6-(1-benzothiophen-2-yl)-1H-pyridin-2-one
6-(1-Benzothiophen-2-yl)pyridin-2(1H)-one
6-(Benzo[b]thiophen-2-yl)pyridin-2-ol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 516.5±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.8±3.0 kJ/mol
    Flash Point: 266.2±27.3 °C
    Index of Refraction: 1.719
    Molar Refractivity: 67.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.56
    ACD/LogD (pH 5.5): 3.52
    ACD/BCF (pH 5.5): 274.27
    ACD/KOC (pH 5.5): 1895.43
    ACD/LogD (pH 7.4): 3.51
    ACD/BCF (pH 7.4): 268.56
    ACD/KOC (pH 7.4): 1855.97
    Polar Surface Area: 61 Å2
    Polarizability: 26.6±0.5 10-24cm3
    Surface Tension: 61.9±3.0 dyne/cm
    Molar Volume: 170.0±3.0 cm3

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