ChemSpider 2D Image | (4R)-2-(3-Hydroxy-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid | C11H13NO4S

(4R)-2-(3-Hydroxy-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid

  • Molecular FormulaC11H13NO4S
  • Average mass255.290 Da
  • Monoisotopic mass255.056534 Da
  • ChemSpider ID22885053

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(4R)-2-(3-Hydroxy-4-methoxyphenyl)-1,3-thiazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
(4R)-2-(3-Hydroxy-4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid [ACD/IUPAC Name]
4-Thiazolidinecarboxylic acid, 2-(3-hydroxy-4-methoxyphenyl)-, (4R)- [ACD/Index Name]
Acide (4R)-2-(3-hydroxy-4-méthoxyphényl)-1,3-thiazolidine-4-carboxylique [French] [ACD/IUPAC Name]
(4R)-2-(3-hydroxy-4-methoxyphenyl)thiazolidine-4-carboxylic acid
(R)-2-(3-Hydroxy-4-methoxy-phenyl)-thiazolidine-4-carboxylic acid
1212456-87-5 [RN]
AKOS021665076
BB_SC-4997
MFCD09859174
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 517.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.1±3.0 kJ/mol
    Flash Point: 266.5±30.1 °C
    Index of Refraction: 1.622
    Molar Refractivity: 64.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.69
    ACD/LogD (pH 5.5): -1.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 104 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 58.8±3.0 dyne/cm
    Molar Volume: 183.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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