ChemSpider 2D Image | 4-(4-Methoxyphenyl)-2-(methylamino)-5-thiazoleacetic acid | C13H14N2O3S

4-(4-Methoxyphenyl)-2-(methylamino)-5-thiazoleacetic acid

  • Molecular FormulaC13H14N2O3S
  • Average mass278.327 Da
  • Monoisotopic mass278.072510 Da
  • ChemSpider ID21436468

More details:

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

[4-(4-Methoxyphenyl)-2-(methylamino)-1,3-thiazol-5-yl]acetic acid [ACD/IUPAC Name]
[4-(4-Methoxyphenyl)-2-(methylamino)-1,3-thiazol-5-yl]essigsäure [German] [ACD/IUPAC Name]
1019107-99-3 [RN]
2-[4-(4-Methoxyphenyl)-2-(methylamino)-1,3-thiazol-5-yl]acetic acid
4-(4-Methoxyphenyl)-2-(methylamino)-5-thiazoleacetic acid
5-Thiazoleacetic acid, 4-(4-methoxyphenyl)-2-(methylamino)- [ACD/Index Name]
Acide [4-(4-méthoxyphényl)-2-(méthylamino)-1,3-thiazol-5-yl]acétique [French] [ACD/IUPAC Name]
[4-(4-Methoxy-phenyl)-2-methylamino-thiazol-5-yl]-acetic acid
1,3-thiazol-5-yl]acetic acid
2-(4-(4-methoxyphenyl)-2-(methylamino)thiazol-5-yl)acetic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 499.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.8±3.0 kJ/mol
    Flash Point: 255.7±31.5 °C
    Index of Refraction: 1.636
    Molar Refractivity: 74.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 0.95
    ACD/BCF (pH 5.5): 1.42
    ACD/KOC (pH 5.5): 17.92
    ACD/LogD (pH 7.4): -0.63
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 100 Å2
    Polarizability: 29.6±0.5 10-24cm3
    Surface Tension: 56.8±3.0 dyne/cm
    Molar Volume: 208.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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