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Search term: JRRYIWXZPLEVHA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Methyl-2-propanyl 4-nitro-1-piperazinecarboxylate | C9H17N3O4

2-Methyl-2-propanyl 4-nitro-1-piperazinecarboxylate

  • Molecular FormulaC9H17N3O4
  • Average mass231.249 Da
  • Monoisotopic mass231.121902 Da
  • ChemSpider ID48059122

More details:

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

1-Piperazinecarboxylic acid, 4-nitro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-nitro-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-nitro-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-Nitro-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1657030-78-8 [RN]
4-tert-Butyloxycarbonyl-1-nitropiperazine
tert-butyl 4-nitropiperazine-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: 374.4±31.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 180.2±24.8 °C
    Index of Refraction: 1.522
    Molar Refractivity: 57.3±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.17
    ACD/LogD (pH 5.5): 0.34
    ACD/BCF (pH 5.5): 1.08
    ACD/KOC (pH 5.5): 36.65
    ACD/LogD (pH 7.4): 0.34
    ACD/BCF (pH 7.4): 1.08
    ACD/KOC (pH 7.4): 36.65
    Polar Surface Area: 79 Å2
    Polarizability: 22.7±0.5 10-24cm3
    Surface Tension: 47.7±5.0 dyne/cm
    Molar Volume: 188.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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