ChemSpider 2D Image | 4,6-Dimethyl-2-pyrimidinecarbothioamide | C7H9N3S

4,6-Dimethyl-2-pyrimidinecarbothioamide

  • Molecular FormulaC7H9N3S
  • Average mass167.232 Da
  • Monoisotopic mass167.051712 Da
  • ChemSpider ID30775220

More details:

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

112627-07-3 [RN]
2-Pyrimidinecarbothioamide, 4,6-dimethyl- [ACD/Index Name]
4,6-Dimethyl-2-pyrimidincarbothioamid [German] [ACD/IUPAC Name]
4,6-Dimethyl-2-pyrimidinecarbothioamide [ACD/IUPAC Name]
4,6-Diméthyl-2-pyrimidinecarbothioamide [French] [ACD/IUPAC Name]
4,6-Dimethylpyrimidine-2-carbothioamide
MFCD20703461

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 349.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.3±3.0 kJ/mol
    Flash Point: 164.9±28.7 °C
    Index of Refraction: 1.634
    Molar Refractivity: 48.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.58
    ACD/LogD (pH 5.5): 0.70
    ACD/BCF (pH 5.5): 2.02
    ACD/KOC (pH 5.5): 57.47
    ACD/LogD (pH 7.4): 0.70
    ACD/BCF (pH 7.4): 2.02
    ACD/KOC (pH 7.4): 57.46
    Polar Surface Area: 84 Å2
    Polarizability: 19.1±0.5 10-24cm3
    Surface Tension: 67.4±3.0 dyne/cm
    Molar Volume: 135.0±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement