ChemSpider 2D Image | tert-Butyl 4-(1-oxo-2,3-dihydro-1H-inden-5-yl)piperazine-1-carboxylate | C18H24N2O3

tert-Butyl 4-(1-oxo-2,3-dihydro-1H-inden-5-yl)piperazine-1-carboxylate

  • Molecular FormulaC18H24N2O3
  • Average mass316.395 Da
  • Monoisotopic mass316.178680 Da
  • ChemSpider ID23960836

More details:

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

1-Piperazinecarboxylic acid, 4-(2,3-dihydro-1-oxo-1H-inden-5-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(1-oxo-2,3-dihydro-1H-inden-5-yl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(1-oxo-2,3-dihydro-1H-inden-5-yl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(1-Oxo-2,3-dihydro-1H-indén-5-yl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
954240-38-1 [RN]
tert-Butyl 4-(1-oxo-2,3-dihydro-1H-inden-5-yl)piperazine-1-carboxylate
[954240-38-1] [RN]
1-boc-4-(1-oxo-indan-5-yl)piperazine
1-BOC-4-(1-OXO-INDAN-5-YL)-PIPERAZINE
4-(1-oxo-2,3-dihydroinden-5-yl)-1-piperazinecarboxylic acid tert-butyl ester
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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: 487.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.4±3.0 kJ/mol
    Flash Point: 248.7±28.7 °C
    Index of Refraction: 1.570
    Molar Refractivity: 87.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.46
    ACD/LogD (pH 5.5): 3.02
    ACD/BCF (pH 5.5): 114.82
    ACD/KOC (pH 5.5): 1034.14
    ACD/LogD (pH 7.4): 3.02
    ACD/BCF (pH 7.4): 116.29
    ACD/KOC (pH 7.4): 1047.39
    Polar Surface Area: 50 Å2
    Polarizability: 34.5±0.5 10-24cm3
    Surface Tension: 48.7±3.0 dyne/cm
    Molar Volume: 265.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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