ChemSpider 2D Image | 5-Aminothieno[2,3-d]pyrimidine-6-carboxylic acid | C7H5N3O2S

5-Aminothieno[2,3-d]pyrimidine-6-carboxylic acid

  • Molecular FormulaC7H5N3O2S
  • Average mass195.199 Da
  • Monoisotopic mass195.010239 Da
  • ChemSpider ID21109199

More details:

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

59488-81-2 [RN]
5-Aminothieno[2,3-d]pyrimidin-6-carbonsäure [German] [ACD/IUPAC Name]
5-Aminothieno[2,3-d]pyrimidine-6-carboxylic acid [ACD/IUPAC Name]
Acide 5-aminothiéno[2,3-d]pyrimidine-6-carboxylique [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-6-carboxylic acid, 5-amino- [ACD/Index Name]
[59488-81-2] [RN]
5-AMINOTHIENO-[2,3-D]-PYRIMIDINE-6-CARBOXYLIC ACID
5-AMINOTHIENO[2,3-D]PYRIMIDINE-6-CARBOXYLICACID
MFCD09701987 [MDL number]

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

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 470.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.2±3.0 kJ/mol
    Flash Point: 238.2±28.7 °C
    Index of Refraction: 1.822
    Molar Refractivity: 49.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.01
    ACD/LogD (pH 5.5): -1.27
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.38
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 117 Å2
    Polarizability: 19.8±0.5 10-24cm3
    Surface Tension: 110.5±3.0 dyne/cm
    Molar Volume: 114.3±3.0 cm3

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