ChemSpider 2D Image | 2-[4-HYDROXY-2-(METHYLSULFANYL)PYRIMIDIN-5-YL]ACETIC ACID | C7H8N2O3S

2-[4-HYDROXY-2-(METHYLSULFANYL)PYRIMIDIN-5-YL]ACETIC ACID

  • Molecular FormulaC7H8N2O3S
  • Average mass200.215 Da
  • Monoisotopic mass200.025558 Da
  • ChemSpider ID23993721

More details:

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

[2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinyl]acetic acid [ACD/IUPAC Name]
[2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinyl]essigsäure [German] [ACD/IUPAC Name]
1087605-38-6 [RN]
2-[4-HYDROXY-2-(METHYLSULFANYL)PYRIMIDIN-5-YL]ACETIC ACID
5-Pyrimidineacetic acid, 3,4-dihydro-2-(methylthio)-4-oxo- [ACD/Index Name]
Acide [2-(méthylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinyl]acétique [French] [ACD/IUPAC Name]
(2-Methylsulfanyl-6-oxo-1,6-dihydro-pyrimidin-5-yl)-acetic acid
(4-Hydroxy-2-methylsulfanyl-pyrimidin-5-yl)-acetic acid
[2-(METHYLSULFANYL)-4-OXO-3H-PYRIMIDIN-5-YL]ACETIC ACID
[2-(methylthio)-6-oxo-1,6-dihydropyrimidin-5-yl]acetic acid
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.659
    Molar Refractivity: 48.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.33
    ACD/LogD (pH 5.5): -1.74
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.59
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 104 Å2
    Polarizability: 19.2±0.5 10-24cm3
    Surface Tension: 61.3±7.0 dyne/cm
    Molar Volume: 131.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement