ChemSpider 2D Image | 3-[(tert-Butoxycarbonyl)amino]-4-(4-fluorophenyl)butanoic acid | C15H20FNO4

3-[(tert-Butoxycarbonyl)amino]-4-(4-fluorophenyl)butanoic acid

  • Molecular FormulaC15H20FNO4
  • Average mass297.322 Da
  • Monoisotopic mass297.137634 Da
  • ChemSpider ID21885604

More details:

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

3-[(tert-Butoxycarbonyl)amino]-4-(4-fluorophenyl)butanoic acid
4-(4-Fluorophenyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butanoic acid [ACD/IUPAC Name]
4-(4-Fluorphenyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butansäure [German] [ACD/IUPAC Name]
683219-73-0 [RN]
Acide 4-(4-fluorophényl)-3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)butanoïque [French] [ACD/IUPAC Name]
Benzenebutanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-4-fluoro- [ACD/Index Name]
β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-fluorobenzenebutanoic acid
(R)-3-tert-Butoxycarbonylamino-4-(4-fluoro-
(S)-3-((tert-Butoxycarbonyl)amino)-4-(4-fluorophenyl)butanoic acid
1H-INDAZOLE,5-(4-FLUOROPHENYL)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 449.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.6±3.0 kJ/mol
    Flash Point: 225.5±27.3 °C
    Index of Refraction: 1.514
    Molar Refractivity: 75.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.23
    ACD/LogD (pH 5.5): 1.72
    ACD/BCF (pH 5.5): 6.00
    ACD/KOC (pH 5.5): 55.37
    ACD/LogD (pH 7.4): -0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 29.8±0.5 10-24cm3
    Surface Tension: 42.4±3.0 dyne/cm
    Molar Volume: 249.4±3.0 cm3

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