ChemSpider 2D Image | ethyl (3R,4R)-3-{[(tert-butoxy)carbonyl]amino}oxane-4-carboxylate | C13H23NO5

ethyl (3R,4R)-3-{[(tert-butoxy)carbonyl]amino}oxane-4-carboxylate

  • Molecular FormulaC13H23NO5
  • Average mass273.325 Da
  • Monoisotopic mass273.157623 Da
  • ChemSpider ID29357500

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-3-({[(2-Méthyl-2-propanyl)oxy]carbonyl}amino)tétrahydro-2H-pyrane-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1363404-85-6 [RN]
2H-Pyran-4-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-, ethyl ester, (3R,4R)- [ACD/Index Name]
2H-Pyran-4-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-, ethyl ester, (3R,4R)-rel-
Ethyl (3R,4R)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)tetrahydro-2H-pyran-4-carboxylate [ACD/IUPAC Name]
ethyl (3R,4R)-3-{[(tert-butoxy)carbonyl]amino}oxane-4-carboxylate
Ethyl-(3R,4R)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)tetrahydro-2H-pyran-4-carboxylat [German] [ACD/IUPAC Name]
cis-Ethyl 3-((tert-butoxycarbonyl)amino)tetrahydro-2H-pyran-4-carboxylate
CIS-ETHYL 3-(BOC-AMINO)-TETRAHYDRO-2H-PYRAN-4-CARBOXYLATE
cis-ethyl3-(boc-amino)-tetrahydro-2h-pyran-4-carboxylate
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 374.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 180.3±27.9 °C
    Index of Refraction: 1.474
    Molar Refractivity: 69.3±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.78
    ACD/LogD (pH 5.5): 1.80
    ACD/BCF (pH 5.5): 13.84
    ACD/KOC (pH 5.5): 228.21
    ACD/LogD (pH 7.4): 1.80
    ACD/BCF (pH 7.4): 13.83
    ACD/KOC (pH 7.4): 228.19
    Polar Surface Area: 74 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 38.2±5.0 dyne/cm
    Molar Volume: 246.5±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement