ChemSpider 2D Image | ETHYL 4-{1-[(TERT-BUTOXY)CARBONYL]PYRROLIDIN-3-YL}PIPERAZINE-1-CARBOXYLATE | C16H29N3O4

ETHYL 4-{1-[(TERT-BUTOXY)CARBONYL]PYRROLIDIN-3-YL}PIPERAZINE-1-CARBOXYLATE

  • Molecular FormulaC16H29N3O4
  • Average mass327.419 Da
  • Monoisotopic mass327.215820 Da
  • ChemSpider ID26457541

More details:

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

1291486-42-4 [RN]
1-Piperazinecarboxylic acid, 4-[1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl]-, ethyl ester [ACD/Index Name]
4-(1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
ETHYL 4-{1-[(TERT-BUTOXY)CARBONYL]PYRROLIDIN-3-YL}PIPERAZINE-1-CARBOXYLATE
Ethyl-4-(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
1-piperazinecarboxylic acid, 4-[1-[(1,1-dimethylethoxy)carbonyl]-3-pyrrolidinyl], ethyl ester
Ethyl 4-(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)piperazine-1-carboxylate
ethyl 4-[1-(tert-butoxycarbonyl)-3-pyrrolidinyl]-1-piperazinecarboxylate
ethyl 4-[1-(tert-butoxycarbonyl)pyrrolidin-3-yl]piperazine-1-carboxylate
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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: 417.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.1±3.0 kJ/mol
    Flash Point: 206.2±28.7 °C
    Index of Refraction: 1.519
    Molar Refractivity: 86.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.89
    ACD/LogD (pH 5.5): 0.08
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 6.61
    ACD/LogD (pH 7.4): 1.29
    ACD/BCF (pH 7.4): 5.32
    ACD/KOC (pH 7.4): 108.16
    Polar Surface Area: 62 Å2
    Polarizability: 34.1±0.5 10-24cm3
    Surface Tension: 45.6±3.0 dyne/cm
    Molar Volume: 283.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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