ChemSpider 2D Image | 3-(2-Ethoxyphenyl)-2,5-dithioxo-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one | C13H11N3O2S3

3-(2-Ethoxyphenyl)-2,5-dithioxo-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one

  • Molecular FormulaC13H11N3O2S3
  • Average mass337.440 Da
  • Monoisotopic mass337.001343 Da
  • ChemSpider ID27318920

More details:

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

3-(2-Ethoxyphenyl)-2,5-dithioxo-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-on [German] [ACD/IUPAC Name]
3-(2-Ethoxyphenyl)-2,5-dithioxo-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one [ACD/IUPAC Name]
3-(2-Éthoxyphényl)-2,5-dithioxo-2,3,5,6-tétrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one [French] [ACD/IUPAC Name]
Thiazolo[4,5-d]pyrimidin-7(4H)-one, 3-(2-ethoxyphenyl)-2,3,5,6-tetrahydro-2,5-dithioxo- [ACD/Index Name]
1326904-08-8 [RN]
3-(2-ethoxyphenyl)-2,5-bis(sulfanylidene)-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
3-(2-Ethoxy-phenyl)-2,5-dithioxo-2,3,5,6-tetrahydro-4H-thiazolo[4,5-d]pyrimidin-7-one

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.804
    Molar Refractivity: 89.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.30
    ACD/LogD (pH 5.5): 0.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 23.80
    ACD/LogD (pH 7.4): -0.80
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.26
    Polar Surface Area: 143 Å2
    Polarizability: 35.6±0.5 10-24cm3
    Surface Tension: 97.2±5.0 dyne/cm
    Molar Volume: 209.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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