ChemSpider 2D Image | tert-Butyl 4-cyano-4-(2-fluoro-4-methylphenyl)piperidine-1-carboxylate | C18H23FN2O2

tert-Butyl 4-cyano-4-(2-fluoro-4-methylphenyl)piperidine-1-carboxylate

  • Molecular FormulaC18H23FN2O2
  • Average mass318.386 Da
  • Monoisotopic mass318.174347 Da
  • ChemSpider ID30776017

More details:

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

1150315-87-9 [RN]
1-Piperidinecarboxylic acid, 4-cyano-4-(2-fluoro-4-methylphenyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-cyano-4-(2-fluoro-4-methylphenyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-cyan-4-(2-fluor-4-methylphenyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-Cyano-4-(2-fluoro-4-méthylphényl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-cyano-4-(2-fluoro-4-methylphenyl)piperidine-1-carboxylate
DS-8902
MFCD24470947
NGAMWHLFIWBSHL-UHFFFAOYSA-N

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 443.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 222.2±28.7 °C
    Index of Refraction: 1.536
    Molar Refractivity: 86.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.20
    ACD/LogD (pH 5.5): 3.81
    ACD/BCF (pH 5.5): 461.68
    ACD/KOC (pH 5.5): 2810.21
    ACD/LogD (pH 7.4): 3.81
    ACD/BCF (pH 7.4): 461.68
    ACD/KOC (pH 7.4): 2810.21
    Polar Surface Area: 53 Å2
    Polarizability: 34.1±0.5 10-24cm3
    Surface Tension: 44.7±5.0 dyne/cm
    Molar Volume: 276.2±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement