ChemSpider 2D Image | 4-[4-(tert-butoxycarbonyl)piperazin-1-yl]pyridine-2-carboxylic acid | C15H21N3O4

4-[4-(tert-butoxycarbonyl)piperazin-1-yl]pyridine-2-carboxylic acid

  • Molecular FormulaC15H21N3O4
  • Average mass307.345 Da
  • Monoisotopic mass307.153198 Da
  • ChemSpider ID23500577

More details:

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

1-Piperazinecarboxylic acid, 4-(2-carboxy-4-pyridinyl)-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
4-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)-2-pyridincarbonsäure [German] [ACD/IUPAC Name]
4-(4-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl)-2-pyridinecarboxylic acid [ACD/IUPAC Name]
4-[4-(tert-butoxycarbonyl)piperazin-1-yl]pyridine-2-carboxylic acid
Acide 4-(4-{[(2-méthyl-2-propanyl)oxy]carbonyl}-1-pipérazinyl)-2-pyridinecarboxylique [French] [ACD/IUPAC Name]
1211595-81-1 [RN]
4-(4-(tert-butoxycarbonyl)piperazin- 1-yl)picolinic acid
4-(4-(tert-butoxycarbonyl)piperazin-1-yl)picolinic acid
4-(4-tert-butoxycarbonylpiperazin-1-yl)pyridine-2-carboxylic acid
4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyridine-2-carboxylic acid
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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: 502.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.3±3.0 kJ/mol
    Flash Point: 257.9±30.1 °C
    Index of Refraction: 1.564
    Molar Refractivity: 79.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.45
    ACD/LogD (pH 5.5): -0.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.92
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 83 Å2
    Polarizability: 31.7±0.5 10-24cm3
    Surface Tension: 53.7±3.0 dyne/cm
    Molar Volume: 245.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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