ChemSpider 2D Image | 2-((tert-Butoxycarbonyl)amino)-2-(oxetan-3-yl)acetic acid | C10H17NO5

2-((tert-Butoxycarbonyl)amino)-2-(oxetan-3-yl)acetic acid

  • Molecular FormulaC10H17NO5
  • Average mass231.246 Da
  • Monoisotopic mass231.110672 Da
  • ChemSpider ID28467425

More details:

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

({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)(3-oxetanyl)acetic acid [ACD/IUPAC Name]
({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)(3-oxetanyl)essigsäure [German] [ACD/IUPAC Name]
1408074-43-0 [RN]
2-((tert-Butoxycarbonyl)amino)-2-(oxetan-3-yl)acetic acid
2-{[(tert-butoxy)carbonyl]amino}-2-(oxetan-3-yl)acetic acid
3-Oxetaneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]- [ACD/Index Name]
Acide ({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)(3-oxétanyl)acétique [French] [ACD/IUPAC Name]
MFCD21848380 [MDL number]
[(TERT-BUTOXYCARBONYL)AMINO](OXETAN-3-YL)ACETIC ACID
{[(tert-Butoxy)carbonyl]amino}(oxetan-3-yl)acetic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 397.7±17.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 71.1±6.0 kJ/mol
    Flash Point: 194.3±20.9 °C
    Index of Refraction: 1.497
    Molar Refractivity: 54.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.73
    ACD/LogD (pH 5.5): -1.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.93
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 85 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 46.8±3.0 dyne/cm
    Molar Volume: 187.1±3.0 cm3

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