ChemSpider 2D Image | 3-{1-[(Benzyloxy)carbonyl]-4-piperidinyl}-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine | C21H30N2O6

3-{1-[(Benzyloxy)carbonyl]-4-piperidinyl}-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine

  • Molecular FormulaC21H30N2O6
  • Average mass406.473 Da
  • Monoisotopic mass406.210388 Da
  • ChemSpider ID21516431

More details:

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

3-{1-[(Benzyloxy)carbonyl]-4-piperidinyl}-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanin [German] [ACD/IUPAC Name]
3-{1-[(Benzyloxy)carbonyl]-4-piperidinyl}-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine [ACD/IUPAC Name]
3-{1-[(Benzyloxy)carbonyl]-4-pipéridinyl}-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}alanine [French] [ACD/IUPAC Name]
4-Piperidinepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-1-[(phenylmethoxy)carbonyl]- [ACD/Index Name]
[195877-90-8] [RN]
195877-90-8 [RN]
21622-00-4 [RN]
3-(1-((Benzyloxy)carbonyl)piperidin-4-yl)-2-((tert-butoxycarbonyl)amino)propanoic acid
3-(1-Cbz-4-piperidyl)-2-(Boc-amino)propanoic Acid
3-[1-[(Benzyloxy)carbonyl]piperidin-4-yl]-n-(tert-butoxycarbonyl)alanine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 578.5±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 91.1±3.0 kJ/mol
    Flash Point: 303.7±25.9 °C
    Index of Refraction: 1.537
    Molar Refractivity: 106.0±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 2.98
    ACD/LogD (pH 5.5): 1.11
    ACD/BCF (pH 5.5): 1.38
    ACD/KOC (pH 5.5): 12.14
    ACD/LogD (pH 7.4): -0.43
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 105 Å2
    Polarizability: 42.0±0.5 10-24cm3
    Surface Tension: 48.2±3.0 dyne/cm
    Molar Volume: 339.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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