ChemSpider 2D Image | 1-Boc-3-(Cbz-amino)azetidine-3-methanol | C17H24N2O5

1-Boc-3-(Cbz-amino)azetidine-3-methanol

  • Molecular FormulaC17H24N2O5
  • Average mass336.383 Da
  • Monoisotopic mass336.168518 Da
  • ChemSpider ID34066171

More details:

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

1363380-94-2 [RN]
1-Azetidinecarboxylic acid, 3-(hydroxymethyl)-3-[[(phenylmethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester [ACD/Index Name]
1-Boc-3-(Cbz-amino)azetidine-3-methanol
2-Methyl-2-propanyl 3-{[(benzyloxy)carbonyl]amino}-3-(hydroxymethyl)-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-{[(benzyloxy)carbonyl]amino}-3-(hydroxymethyl)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-{[(Benzyloxy)carbonyl]amino}-3-(hydroxyméthyl)-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
atoms 24 bonds 25
MFCD23105885
TERT-BUTYL 3-{[(BENZYLOXY)CARBONYL]AMINO}-3-(HYDROXYMETHYL)AZETIDINE-1-CARBOXYLATE

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 493.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.1±3.0 kJ/mol
    Flash Point: 252.1±28.7 °C
    Index of Refraction: 1.569
    Molar Refractivity: 88.4±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 1.89
    ACD/LogD (pH 5.5): 1.96
    ACD/BCF (pH 5.5): 18.22
    ACD/KOC (pH 5.5): 277.93
    ACD/LogD (pH 7.4): 1.96
    ACD/BCF (pH 7.4): 18.22
    ACD/KOC (pH 7.4): 277.90
    Polar Surface Area: 88 Å2
    Polarizability: 35.1±0.5 10-24cm3
    Surface Tension: 53.3±5.0 dyne/cm
    Molar Volume: 270.1±5.0 cm3

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