ChemSpider 2D Image | ethyl 5-{[(tert-butoxy)carbonyl]amino}-1,2-oxazole-3-carboxylate | C11H16N2O5

ethyl 5-{[(tert-butoxy)carbonyl]amino}-1,2-oxazole-3-carboxylate

  • Molecular FormulaC11H16N2O5
  • Average mass256.255 Da
  • Monoisotopic mass256.105927 Da
  • ChemSpider ID28599862

More details:

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

138742-18-4 [RN]
3-Isoxazolecarboxylic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-, ethyl ester [ACD/Index Name]
5-({[(2-Méthyl-2-propanyl)oxy]carbonyl}amino)-1,2-oxazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1,2-oxazole-3-carboxylate [ACD/IUPAC Name]
ethyl 5-{[(tert-butoxy)carbonyl]amino}-1,2-oxazole-3-carboxylate
Ethyl-5-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1,2-oxazol-3-carboxylat [German] [ACD/IUPAC Name]
[138742-18-4] [RN]
ethyl 5-((tert-butoxycarbonyl)-amino)isoxazole-3-carboxylate
Ethyl 5-((tert-butoxycarbonyl)amino)isoxazole-3-carboxylate
Ethyl 5-(t-butoxycarbonylamino)isoxazole-3-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 333.8±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.7±3.0 kJ/mol
    Flash Point: 155.7±23.7 °C
    Index of Refraction: 1.514
    Molar Refractivity: 62.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.39
    ACD/LogD (pH 5.5): 2.10
    ACD/BCF (pH 5.5): 23.01
    ACD/KOC (pH 5.5): 328.49
    ACD/LogD (pH 7.4): 2.10
    ACD/BCF (pH 7.4): 23.01
    ACD/KOC (pH 7.4): 328.48
    Polar Surface Area: 91 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 44.0±3.0 dyne/cm
    Molar Volume: 208.9±3.0 cm3

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