ChemSpider 2D Image | 2-(6-Acetyl-3,5-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamide | C12H13N3O4S

2-(6-Acetyl-3,5-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamide

  • Molecular FormulaC12H13N3O4S
  • Average mass295.314 Da
  • Monoisotopic mass295.062683 Da
  • ChemSpider ID21530328

More details:

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

2-(6-Acetyl-3,5-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamid [German] [ACD/IUPAC Name]
2-(6-Acetyl-3,5-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)acetamide [ACD/IUPAC Name]
2-(6-Acétyl-3,5-diméthyl-2,4-dioxo-3,4-dihydrothiéno[2,3-d]pyrimidin-1(2H)-yl)acétamide [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-1(2H)-acetamide, 6-acetyl-3,4-dihydro-3,5-dimethyl-2,4-dioxo- [ACD/Index Name]
2-(6-acetyl-3,5-dimethyl-2,4-dioxothieno[2,3-d]pyrimidin-1-yl)acetamide
919733-67-8 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 603.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 89.7±3.0 kJ/mol
    Flash Point: 318.6±34.3 °C
    Index of Refraction: 1.613
    Molar Refractivity: 72.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.41
    ACD/LogD (pH 5.5): -0.08
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 21.56
    ACD/LogD (pH 7.4): -0.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 21.56
    Polar Surface Area: 129 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 60.4±3.0 dyne/cm
    Molar Volume: 207.0±3.0 cm3

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