ChemSpider 2D Image | 1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-3-carboxylic acid | C10H15F2NO4

1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-3-carboxylic acid

  • Molecular FormulaC10H15F2NO4
  • Average mass251.227 Da
  • Monoisotopic mass251.096909 Da
  • ChemSpider ID29784197

More details:

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

1,3-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-3-carboxylic acid
1196145-11-5 [RN]
4,4-Difluor-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
4,4-Difluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
Acide 4,4-difluoro-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
[1196145-11-5] [RN]
1-(tert-butoxycarbonyl)-4,4-difluoropyrrolidine-3-carboxylic acid
1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-3-carboxylicacid
4,4-Difluoro-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 340.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 64.2±6.0 kJ/mol
    Flash Point: 159.7±27.9 °C
    Index of Refraction: 1.475
    Molar Refractivity: 53.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.00
    ACD/LogD (pH 5.5): -1.31
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.52
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 21.4±0.5 10-24cm3
    Surface Tension: 40.7±5.0 dyne/cm
    Molar Volume: 191.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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