ChemSpider 2D Image | Butyl 2-({(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethoxy-2-oxoethylidene]amino}oxy)-2-methylpropanoate | C15H23N3O5S

Butyl 2-({(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethoxy-2-oxoethylidene]amino}oxy)-2-methylpropanoate

  • Molecular FormulaC15H23N3O5S
  • Average mass357.425 Da
  • Monoisotopic mass357.135834 Da
  • ChemSpider ID26404010

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({(Z)-[1-(2-Amino-1,3-thiazol-4-yl)-2-éthoxy-2-oxoéthylidène]amino}oxy)-2-méthylpropanoate de butyle [French] [ACD/IUPAC Name]
4-Thiazoleacetic acid, 2-amino-α-[(2-butoxy-1,1-dimethyl-2-oxoethoxy)imino]-, ethyl ester, (αZ)- [ACD/Index Name]
Butyl 2-({(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethoxy-2-oxoethylidene]amino}oxy)-2-methylpropanoate [ACD/IUPAC Name]
Butyl-2-({(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethoxy-2-oxoethyliden]amino}oxy)-2-methylpropanoat [German] [ACD/IUPAC Name]
(Z)-Butyl 2-(((1-(2-aminothiazol-4-yl)-2-ethoxy-2-oxoethylidene)amino)oxy)-2-methylpropanoate
13526-66-4 [RN]
1564141-28-1 [RN]
86299-46-9 [RN]
BR-72862
butyl 2-[(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethoxy-2-oxoethylidene]amino]oxy-2-methylpropanoate
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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: 473.1±51.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.6±3.0 kJ/mol
    Flash Point: 239.9±30.4 °C
    Index of Refraction: 1.555
    Molar Refractivity: 90.6±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 3.39
    ACD/LogD (pH 5.5): 2.94
    ACD/BCF (pH 5.5): 101.83
    ACD/KOC (pH 5.5): 952.46
    ACD/LogD (pH 7.4): 2.94
    ACD/BCF (pH 7.4): 101.84
    ACD/KOC (pH 7.4): 952.52
    Polar Surface Area: 141 Å2
    Polarizability: 35.9±0.5 10-24cm3
    Surface Tension: 44.4±7.0 dyne/cm
    Molar Volume: 282.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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