ChemSpider 2D Image | 2-thien-2-ylpyrimidine-5-carboxylic acid | C9H6N2O2S

2-thien-2-ylpyrimidine-5-carboxylic acid

  • Molecular FormulaC9H6N2O2S
  • Average mass206.221 Da
  • Monoisotopic mass206.014999 Da
  • ChemSpider ID21393623

More details:

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

2-(2-Thienyl)-5-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
2-(2-Thienyl)-5-pyrimidinecarboxylic acid [ACD/IUPAC Name]
2-(2-Thienyl)pyrimidine-5-carboxylic acid
2-(THIOPHEN-2-YL)PYRIMIDINE-5-CARBOXYLIC ACID
2-thien-2-ylpyrimidine-5-carboxylic acid
5-Pyrimidinecarboxylic acid, 2-(2-thienyl)- [ACD/Index Name]
916766-97-7 [RN]
Acide 2-(2-thiényl)-5-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
MFCD09817551 [MDL number]
2-(5-Carboxypyrimidin-2-yl)thiophene
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 309.7±24.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.1±3.0 kJ/mol
    Flash Point: 141.1±22.9 °C
    Index of Refraction: 1.652
    Molar Refractivity: 52.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.60
    ACD/LogD (pH 5.5): -0.68
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.37
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 91 Å2
    Polarizability: 20.8±0.5 10-24cm3
    Surface Tension: 70.1±3.0 dyne/cm
    Molar Volume: 143.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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