ChemSpider 2D Image | tert-Butyl 3-nitropyrrolidine-1-carboxylate | C9H16N2O4

tert-Butyl 3-nitropyrrolidine-1-carboxylate

  • Molecular FormulaC9H16N2O4
  • Average mass216.234 Da
  • Monoisotopic mass216.111008 Da
  • ChemSpider ID28536736

More details:

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

1309581-43-8 [RN]
1-Pyrrolidinecarboxylic acid, 3-nitro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-nitro-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-nitro-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-Nitro-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 3-nitropyrrolidine-1-carboxylate
[1309581-43-8] [RN]
3-Nitropyrrolidine-1-carboxylic acid tert-butyl ester
3-Nitro-pyrrolidine-1-carboxylic acid tert-Butyl ester
3-nitro-pyrrolidine-1-carboxylic acid tert-butyl ester(wx690044)
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 310.4±31.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.1±3.0 kJ/mol
    Flash Point: 141.5±24.8 °C
    Index of Refraction: 1.499
    Molar Refractivity: 53.4±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.03
    ACD/LogD (pH 5.5): 1.37
    ACD/BCF (pH 5.5): 6.49
    ACD/KOC (pH 5.5): 132.55
    ACD/LogD (pH 7.4): 1.19
    ACD/BCF (pH 7.4): 4.27
    ACD/KOC (pH 7.4): 87.25
    Polar Surface Area: 75 Å2
    Polarizability: 21.2±0.5 10-24cm3
    Surface Tension: 42.8±5.0 dyne/cm
    Molar Volume: 182.1±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement