ChemSpider 2D Image | 2-(2-Methoxyethoxy)-4-methyl-1,3-thiazole-5-carboxylic acid | C8H11NO4S

2-(2-Methoxyethoxy)-4-methyl-1,3-thiazole-5-carboxylic acid

  • Molecular FormulaC8H11NO4S
  • Average mass217.242 Da
  • Monoisotopic mass217.040878 Da
  • ChemSpider ID26457834

More details:

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

1338494-94-2 [RN]
2-(2-Methoxyethoxy)-4-methyl-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-(2-Methoxyethoxy)-4-methyl-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-(2-methoxyethoxy)-4-methyl- [ACD/Index Name]
Acide 2-(2-méthoxyéthoxy)-4-méthyl-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]
2-(2-methoxyethoxy)-4-methylthiazole-5-carboxylic acid
MFCD20441365 [MDL number]
VS-11835

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 366.7±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.7±3.0 kJ/mol
    Flash Point: 175.6±30.7 °C
    Index of Refraction: 1.548
    Molar Refractivity: 52.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.35
    ACD/LogD (pH 5.5): -1.37
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.97
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 97 Å2
    Polarizability: 20.7±0.5 10-24cm3
    Surface Tension: 51.5±3.0 dyne/cm
    Molar Volume: 164.3±3.0 cm3

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