ChemSpider 2D Image | tert-butyl 2-(2,4-dioxo-1,3-thiazolidin-3-yl)acetate | C9H13NO4S

tert-butyl 2-(2,4-dioxo-1,3-thiazolidin-3-yl)acetate

  • Molecular FormulaC9H13NO4S
  • Average mass231.269 Da
  • Monoisotopic mass231.056534 Da
  • ChemSpider ID35496867

More details:

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

(2,4-Dioxo-1,3-thiazolidin-3-yl)acétate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (2,4-dioxo-1,3-thiazolidin-3-yl)acetate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2,4-dioxo-1,3-thiazolidin-3-yl)acetat [German] [ACD/IUPAC Name]
3-Thiazolidineacetic acid, 2,4-dioxo-, 1,1-dimethylethyl ester [ACD/Index Name]
50773-27-8 [RN]
tert-butyl 2-(2,4-dioxo-1,3-thiazolidin-3-yl)acetate
(2,4-dioxothiazolidin-3-yl)acetic acid tert-butyl ester
(2,4-Dioxo-thiazolidin-3-yl)-acetic acid tert-butyl ester
AGN-PC-0OBELO
BKUAQGWOPUHCQD-UHFFFAOYSA-N
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 321.2±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.3±3.0 kJ/mol
    Flash Point: 148.1±28.4 °C
    Index of Refraction: 1.530
    Molar Refractivity: 55.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.72
    ACD/LogD (pH 5.5): 1.15
    ACD/BCF (pH 5.5): 4.40
    ACD/KOC (pH 5.5): 100.55
    ACD/LogD (pH 7.4): 1.15
    ACD/BCF (pH 7.4): 4.40
    ACD/KOC (pH 7.4): 100.55
    Polar Surface Area: 89 Å2
    Polarizability: 22.0±0.5 10-24cm3
    Surface Tension: 47.8±3.0 dyne/cm
    Molar Volume: 179.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement