ChemSpider 2D Image | 6-(3-Thienyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone | C8H6N2OS2

6-(3-Thienyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone

  • Molecular FormulaC8H6N2OS2
  • Average mass210.276 Da
  • Monoisotopic mass209.992157 Da
  • ChemSpider ID28614574

More details:

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

4(1H)-Pyrimidinone, 2,3-dihydro-6-(3-thienyl)-2-thioxo- [ACD/Index Name]
6-(3-Thienyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
6-(3-Thienyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [ACD/IUPAC Name]
6-(3-Thiényl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
1432103-84-8 [RN]
2-SULFANYL-6-(THIOPHEN-3-YL)PYRIMIDIN-4-OL
6-(thiophen-3-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
MFCD21291676

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 434.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.7±3.0 kJ/mol
    Flash Point: 216.4±31.5 °C
    Index of Refraction: 1.712
    Molar Refractivity: 55.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.42
    ACD/LogD (pH 5.5): -1.39
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 113 Å2
    Polarizability: 22.0±0.5 10-24cm3
    Surface Tension: 74.0±3.0 dyne/cm
    Molar Volume: 141.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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