ChemSpider 2D Image | 5-bromo-2-sulfanylpyrimidin-4-ol | C4H3BrN2OS

5-bromo-2-sulfanylpyrimidin-4-ol

  • Molecular FormulaC4H3BrN2OS
  • Average mass207.048 Da
  • Monoisotopic mass205.914932 Da
  • ChemSpider ID15503797

More details:

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

113138-12-8 [RN]
4(1H)-Pyrimidinone, 5-bromo-2,3-dihydro-2-thioxo- [ACD/Index Name]
5-Brom-2-thioxo-2,3-dihydro-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-bromo-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
5-bromo-2-sulfanylpyrimidin-4-ol
5-Bromo-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [ACD/IUPAC Name]
5-Bromo-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
5-bromo-2,3-dihydro-2-thioxo-4(1h)-pyrimidinone
5-Bromo-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one
5-bromo-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 2.1±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.734
    Molar Refractivity: 40.5±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.08
    ACD/LogD (pH 5.5): -0.09
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 20.49
    ACD/LogD (pH 7.4): -0.96
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.75
    Polar Surface Area: 73 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 84.0±5.0 dyne/cm
    Molar Volume: 101.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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