ChemSpider 2D Image | Ethyl 2-(4-(tert-butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylate | C15H23N3O4S

Ethyl 2-(4-(tert-butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylate

  • Molecular FormulaC15H23N3O4S
  • Average mass341.426 Da
  • Monoisotopic mass341.140930 Da
  • ChemSpider ID24598255

More details:

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

1-Piperazinecarboxylic acid, 4-[4-(ethoxycarbonyl)-2-thiazolyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-[4-(Éthoxycarbonyl)-1,3-thiazol-2-yl]-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
867065-53-0 [RN]
Ethyl 2-(4-(tert-butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylate
tert-Butyl 4-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]piperazine-1-carboxylate
[365413-31-6] [RN]
[867065-53-0] [RN]
365413-31-6 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 455.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.5±3.0 kJ/mol
    Flash Point: 229.3±31.5 °C
    Index of Refraction: 1.546
    Molar Refractivity: 87.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.44
    ACD/LogD (pH 5.5): 2.60
    ACD/BCF (pH 5.5): 55.44
    ACD/KOC (pH 5.5): 611.04
    ACD/LogD (pH 7.4): 2.61
    ACD/BCF (pH 7.4): 57.15
    ACD/KOC (pH 7.4): 629.81
    Polar Surface Area: 100 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 49.1±3.0 dyne/cm
    Molar Volume: 277.0±3.0 cm3

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