ChemSpider 2D Image | Boc-Homoserine | C9H17NO5


  • Molecular FormulaC9H17NO5
  • Average mass219.235 Da
  • Monoisotopic mass219.110672 Da
  • ChemSpider ID23346402
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Homoserine, N-[(1,1-dimethylethoxy)carbonyl]- [ACD/Index Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-homoserin [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-homoserine [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-L-homosérine [French] [ACD/IUPAC Name]
(2S)-2-[(tert-butoxy)carbonylamino]-4-hydroxybutanoic acid
(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-hydroxybutanoic acid
(2S)-4-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

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

  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-36753]
    • Safety:

      20/21/22 Novochemy [NC-36753]
      20/21/36/37/39 Novochemy [NC-36753]
      CAUTION: May irritate eyes, skin, and respiratory tract Alfa Aesar H52829
      GHS07; GHS09 Novochemy [NC-36753]
      H332; H403 Novochemy [NC-36753]
      IRRITANT Matrix Scientific 075122
      P309+P311; P211; P242 Novochemy [NC-36753]
      Warning Novochemy [NC-36753]
      Xn Novochemy [NC-36753]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 421.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±6.0 kJ/mol
Flash Point: 208.8±27.3 °C
Index of Refraction: 1.485
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -1.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 182.0±3.0 cm3

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