ChemSpider 2D Image | (2S)-2-{[(tert-butoxy)carbonyl]amino}-4-{[({[(tert-butoxy)carbonyl]amino}methanimidoyl)amino]oxy}butanoic acid | C15H28N4O7

(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-{[({[(tert-butoxy)carbonyl]amino}methanimidoyl)amino]oxy}butanoic acid

  • Molecular FormulaC15H28N4O7
  • Average mass376.405 Da
  • Monoisotopic mass376.195801 Da
  • ChemSpider ID77006311

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-{[({[(tert-butoxy)carbonyl]amino}methanimidoyl)amino]oxy}butanoic acid
165105-47-5 [RN]
L-Homoserine, N-[(1,1-dimethylethoxy)carbonyl]-O-[[[[(1,1-dimethylethoxy)carbonyl]amino]iminomethyl]amino]- [ACD/Index Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-O-(N'-{[(2-methyl-2-propanyl)oxy]carbonyl}carbamimidamido)-L-homoserin [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-O-(N'-{[(2-methyl-2-propanyl)oxy]carbonyl}carbamimidamido)-L-homoserine [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-O-(N'-{[(2-méthyl-2-propanyl)oxy]carbonyl}carbamimidamido)-L-homosérine [French] [ACD/IUPAC Name]
(s)-4-[(3-boc-guanidino)oxy]-2-(boc-amino)butanoic acid
MFCD31710648

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.516
    Molar Refractivity: 90.3±0.5 cm3
    #H bond acceptors: 11
    #H bond donors: 5
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 2.02
    ACD/LogD (pH 5.5): -0.69
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.15
    ACD/LogD (pH 7.4): -2.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 159 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 42.8±7.0 dyne/cm
    Molar Volume: 299.1±7.0 cm3

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