ChemSpider 2D Image | {[(5,6-Dimethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetic acid | C11H12N2O3S2

{[(5,6-Dimethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetic acid

  • Molecular FormulaC11H12N2O3S2
  • Average mass284.355 Da
  • Monoisotopic mass284.028931 Da
  • ChemSpider ID24600353

More details:

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

{[(5,6-Dimethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetic acid [ACD/IUPAC Name]
{[(5,6-Dimethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[[(3,4-dihydro-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)methyl]thio]- [ACD/Index Name]
Acide {[(5,6-diméthyl-4-oxo-1,4-dihydrothiéno[2,3-d]pyrimidin-2-yl)méthyl]sulfanyl}acétique [French] [ACD/IUPAC Name]
(4-Hydroxy-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-ylmethylsulfanyl)-acetic acid
(5,6-Dimethyl-4-oxo-3,4-dihydro-thieno[2,3-d]pyrimidin-2-ylmethylsulfanyl)-acetic acid
{[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetic acid
{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetic acid
{[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]thio}acetic acid
1096952-23-6 [RN]
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    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: 1.726
    Molar Refractivity: 72.1±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.77
    ACD/LogD (pH 5.5): -0.43
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.96
    ACD/LogD (pH 7.4): -2.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 132 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 62.6±7.0 dyne/cm
    Molar Volume: 181.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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