ChemSpider 2D Image | 3-(Boc-amino)-3-(4-fluorophenyl)-1-propanol | C14H20FNO3

3-(Boc-amino)-3-(4-fluorophenyl)-1-propanol

  • Molecular FormulaC14H20FNO3
  • Average mass269.312 Da
  • Monoisotopic mass269.142731 Da
  • ChemSpider ID21373606

More details:

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

[1-(4-Fluorophényl)-3-hydroxypropyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [1-(4-fluorophenyl)-3-hydroxypropyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[1-(4-fluorphenyl)-3-hydroxypropyl]carbamat [German] [ACD/IUPAC Name]
3-(Boc-amino)-3-(4-fluorophenyl)-1-propanol
862466-16-8 [RN]
Carbamic acid, N-[1-(4-fluorophenyl)-3-hydroxypropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl [1-(4-fluorophenyl)-3-hydroxypropyl]carbamate
[1-(4-Fluoro-phenyl)-3-hydroxy-propyl]-carbamic acid tert-butyl ester
[862466-16-8] [RN]
3-N-Boc-amino-3-(4-fluoro-phenyl)-propan-1-ol
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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: 407.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.6±3.0 kJ/mol
    Flash Point: 200.4±27.3 °C
    Index of Refraction: 1.509
    Molar Refractivity: 70.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.19
    ACD/KOC (pH 5.5): 417.67
    ACD/LogD (pH 7.4): 2.29
    ACD/BCF (pH 7.4): 32.19
    ACD/KOC (pH 7.4): 417.65
    Polar Surface Area: 59 Å2
    Polarizability: 27.9±0.5 10-24cm3
    Surface Tension: 39.8±3.0 dyne/cm
    Molar Volume: 236.1±3.0 cm3

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