ChemSpider 2D Image | TERT-BUTYL N-(3-{[(BENZYLOXY)CARBONYL]AMINO}PROPYL)-N-METHYLCARBAMATE | C17H26N2O4

TERT-BUTYL N-(3-{[(BENZYLOXY)CARBONYL]AMINO}PROPYL)-N-METHYLCARBAMATE

  • Molecular FormulaC17H26N2O4
  • Average mass322.399 Da
  • Monoisotopic mass322.189270 Da
  • ChemSpider ID23960430

More details:

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

[3-(Méthyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)propyl]carbamate de benzyle [French] [ACD/IUPAC Name]
1131594-82-5 [RN]
Benzyl [3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propyl]carbamate [ACD/IUPAC Name]
Benzyl-[3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propyl]carbamat [German] [ACD/IUPAC Name]
TERT-BUTYL N-(3-{[(BENZYLOXY)CARBONYL]AMINO}PROPYL)-N-METHYLCARBAMATE
[1131594-82-5] [RN]
1-N-Boc-Amino-1-N-methyl-3-N-Cbz-aminopropane
1-N-BOC-amino-1-N-methyl-3-N-CBZ-amino-propane
Benzyl {3-[(tert-butoxycarbonyl)(methyl)amino]propyl}carbamate (non-preferred name)
BENZYL N-(3-{[(TERT-BUTOXY)CARBONYL](METHYL)AMINO}PROPYL)CARBAMATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 453.8±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.3±3.0 kJ/mol
    Flash Point: 228.3±25.7 °C
    Index of Refraction: 1.513
    Molar Refractivity: 88.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.64
    ACD/LogD (pH 5.5): 3.28
    ACD/BCF (pH 5.5): 181.65
    ACD/KOC (pH 5.5): 1441.36
    ACD/LogD (pH 7.4): 3.28
    ACD/BCF (pH 7.4): 181.65
    ACD/KOC (pH 7.4): 1441.35
    Polar Surface Area: 68 Å2
    Polarizability: 35.0±0.5 10-24cm3
    Surface Tension: 40.2±3.0 dyne/cm
    Molar Volume: 293.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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