ChemSpider 2D Image | 2-Methyl-2-propanyl 4-(4-acetyl-2-nitrophenyl)-1-piperazinecarboxylate | C17H23N3O5

2-Methyl-2-propanyl 4-(4-acetyl-2-nitrophenyl)-1-piperazinecarboxylate

  • Molecular FormulaC17H23N3O5
  • Average mass349.382 Da
  • Monoisotopic mass349.163757 Da
  • ChemSpider ID29204277

More details:

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

1-Piperazinecarboxylic acid, 4-(4-acetyl-2-nitrophenyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(4-acetyl-2-nitrophenyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(4-acetyl-2-nitrophenyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(4-Acétyl-2-nitrophényl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1052705-18-6 [RN]
1-piperazinecarboxylic acid, 4-(4-acetyl-2-nitrophenyl), 1,1-dimethylethyl ester
MFCD17866458 [MDL number]
tert-butyl 4-(4-acetyl-2-nitrophenyl)piperazine-1-carboxylate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 485.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.0±3.0 kJ/mol
    Flash Point: 247.2±28.7 °C
    Index of Refraction: 1.559
    Molar Refractivity: 91.4±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.05
    ACD/LogD (pH 5.5): 2.69
    ACD/BCF (pH 5.5): 65.52
    ACD/KOC (pH 5.5): 694.65
    ACD/LogD (pH 7.4): 2.69
    ACD/BCF (pH 7.4): 65.52
    ACD/KOC (pH 7.4): 694.65
    Polar Surface Area: 96 Å2
    Polarizability: 36.2±0.5 10-24cm3
    Surface Tension: 49.0±3.0 dyne/cm
    Molar Volume: 283.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement