ChemSpider 2D Image | MFCD11590790 | C17H27N3O2

MFCD11590790

  • Molecular FormulaC17H27N3O2
  • Average mass305.415 Da
  • Monoisotopic mass305.210327 Da
  • ChemSpider ID23355268

More details:

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

1-Piperazinecarboxylic acid, 4-[2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[2-(4-aminophenyl)ethyl]-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[2-(4-aminophenyl)ethyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
329004-08-2 [RN]
4-(4-aminophenethyl)piperazine-1-carboxylic acid tert-butyl ester
4-[2-(4-Aminophényl)éthyl]-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
MFCD11590790
tert-Butyl 4-[2-(4-aminophenyl)ethyl]piperazine-1-carboxylate
4-(4-aminophenethyl)piperazine-1-carboxylicacidtert-butylester
4-[2-(4-Boc-piperazin-1-yl)ethyl]aniline
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 433.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.9±3.0 kJ/mol
    Flash Point: 215.9±27.3 °C
    Index of Refraction: 1.553
    Molar Refractivity: 88.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.61
    ACD/LogD (pH 5.5): 1.13
    ACD/BCF (pH 5.5): 1.95
    ACD/KOC (pH 5.5): 22.48
    ACD/LogD (pH 7.4): 2.42
    ACD/BCF (pH 7.4): 38.34
    ACD/KOC (pH 7.4): 441.37
    Polar Surface Area: 59 Å2
    Polarizability: 35.1±0.5 10-24cm3
    Surface Tension: 45.4±3.0 dyne/cm
    Molar Volume: 276.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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