ChemSpider 2D Image | Methyl 2-amino-4-butyl-1,3-thiazole-5-carboxylate | C9H14N2O2S

Methyl 2-amino-4-butyl-1,3-thiazole-5-carboxylate

  • Molecular FormulaC9H14N2O2S
  • Average mass214.285 Da
  • Monoisotopic mass214.077591 Da
  • ChemSpider ID25082846

More details:

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

2-Amino-4-butyl-1,3-thiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-amino-4-butyl-, methyl ester [ACD/Index Name]
Methyl 2-amino-4-butyl-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Methyl-2-amino-4-butyl-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]
1245569-75-8 [RN]
2-Amino-4-butyl-thiazole-5-carboxylic acid methyl ester
AGN-PC-08YJAZ
AKOS005756781
BB_SC-9223
BBL032810
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 363.4±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.9±3.0 kJ/mol
    Flash Point: 173.6±24.6 °C
    Index of Refraction: 1.559
    Molar Refractivity: 57.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.41
    ACD/LogD (pH 5.5): 2.13
    ACD/BCF (pH 5.5): 24.32
    ACD/KOC (pH 5.5): 339.42
    ACD/LogD (pH 7.4): 2.14
    ACD/BCF (pH 7.4): 24.91
    ACD/KOC (pH 7.4): 347.60
    Polar Surface Area: 93 Å2
    Polarizability: 22.8±0.5 10-24cm3
    Surface Tension: 49.0±3.0 dyne/cm
    Molar Volume: 178.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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