ChemSpider 2D Image | 2-Methylthiazole-5-carbonitrile | C5H4N2S

2-Methylthiazole-5-carbonitrile

  • Molecular FormulaC5H4N2S
  • Average mass124.164 Da
  • Monoisotopic mass124.009521 Da
  • ChemSpider ID27165835

More details:

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

2-Methyl-1,3-thiazol-5-carbonitril [German] [ACD/IUPAC Name]
2-Methyl-1,3-thiazole-5-carbonitrile [ACD/IUPAC Name]
2-Méthyl-1,3-thiazole-5-carbonitrile [French] [ACD/IUPAC Name]
2-Methylthiazole-5-carbonitrile
5-Thiazolecarbonitrile, 2-methyl- [ACD/Index Name]
65735-10-6 [RN]
[60735-10-6] [RN]
2-Methyl-thiazole-5-carbonitrile
60735-10-6 [RN]
MFCD11506340 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 229.4±13.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 46.6±3.0 kJ/mol
    Flash Point: 92.5±19.8 °C
    Index of Refraction: 1.559
    Molar Refractivity: 31.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.54
    ACD/LogD (pH 5.5): 0.71
    ACD/BCF (pH 5.5): 2.05
    ACD/KOC (pH 5.5): 58.20
    ACD/LogD (pH 7.4): 0.71
    ACD/BCF (pH 7.4): 2.05
    ACD/KOC (pH 7.4): 58.20
    Polar Surface Area: 65 Å2
    Polarizability: 12.6±0.5 10-24cm3
    Surface Tension: 57.2±5.0 dyne/cm
    Molar Volume: 98.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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