ChemSpider 2D Image | 5-bromo-2-(ethylthio)pyrimidine | C6H7BrN2S

5-bromo-2-(ethylthio)pyrimidine

  • Molecular FormulaC6H7BrN2S
  • Average mass219.102 Da
  • Monoisotopic mass217.951324 Da
  • ChemSpider ID24794007

More details:

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

5-Brom-2-(ethylsulfanyl)pyrimidin [German] [ACD/IUPAC Name]
5-Bromo-2-(ethylsulfanyl)pyrimidine [ACD/IUPAC Name]
5-Bromo-2-(éthylsulfanyl)pyrimidine [French] [ACD/IUPAC Name]
5-bromo-2-(ethylthio)pyrimidine
859941-10-9 [RN]
MFCD13188492 [MDL number]
Pyrimidine, 5-bromo-2-(ethylthio)- [ACD/Index Name]
[859941-10-9] [RN]
5-Bromo-2-(ethyl thio)pyrimidine
5-bromo-2-ethylsulfanylpyrimidine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 291.6±13.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.0±3.0 kJ/mol
    Flash Point: 130.1±19.8 °C
    Index of Refraction: 1.615
    Molar Refractivity: 47.3±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.54
    ACD/LogD (pH 5.5): 2.26
    ACD/BCF (pH 5.5): 30.61
    ACD/KOC (pH 5.5): 402.89
    ACD/LogD (pH 7.4): 2.26
    ACD/BCF (pH 7.4): 30.61
    ACD/KOC (pH 7.4): 402.89
    Polar Surface Area: 51 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 60.4±5.0 dyne/cm
    Molar Volume: 135.7±5.0 cm3

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