ChemSpider 2D Image | 1-(1,1-Dimethylethyl) 5-phenyl-1,3-pyrrolidinedicarboxylate | C16H21NO4

1-(1,1-Dimethylethyl) 5-phenyl-1,3-pyrrolidinedicarboxylate

  • Molecular FormulaC16H21NO4
  • Average mass291.342 Da
  • Monoisotopic mass291.147064 Da
  • ChemSpider ID24534459

More details:

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

1-(1,1-Dimethylethyl) 5-phenyl-1,3-pyrrolidinedicarboxylate
1-(tert-butoxycarbonyl)-5-phenylpyrrolidine-3-carboxylic acid
1,3-Pyrrolidinedicarboxylic acid, 5-phenyl-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-phenyl-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-phenyl-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
5-phenylpyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester
885277-76-9 [RN]
Acide 1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-5-phényl-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
[885277-76-9] [RN]
1-(Boc)-5-Phenyl-pyrrolidine-3-carboxylic acid
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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: 1.2±0.1 g/cm3
    Boiling Point: 441.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.6±3.0 kJ/mol
    Flash Point: 220.8±28.7 °C
    Index of Refraction: 1.549
    Molar Refractivity: 77.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.32
    ACD/LogD (pH 5.5): 1.57
    ACD/BCF (pH 5.5): 4.82
    ACD/KOC (pH 5.5): 50.11
    ACD/LogD (pH 7.4): -0.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 243.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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