ChemSpider 2D Image | tert-butyl 3-(4-cyanophenyl)-3-oxetanylcarbamate | C15H18N2O3

tert-butyl 3-(4-cyanophenyl)-3-oxetanylcarbamate

  • Molecular FormulaC15H18N2O3
  • Average mass274.315 Da
  • Monoisotopic mass274.131744 Da
  • ChemSpider ID28467424

More details:

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

[3-(4-Cyanophényl)-3-oxétanyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1158098-77-1 [RN]
2-Methyl-2-propanyl [3-(4-cyanophenyl)-3-oxetanyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[3-(4-cyanphenyl)-3-oxetanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-(4-cyanophenyl)-3-oxetanyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
MFCD17215904 [MDL number]
tert-butyl 3-(4-cyanophenyl)-3-oxetanylcarbamate
tert-butyl N-[3-(4-cyanophenyl)oxetan-3-yl]carbamate
(2-Methylpyridin-4-yl)methanol
1258652-18-4 [RN]
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: 436.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.3±3.0 kJ/mol
    Flash Point: 217.6±28.7 °C
    Index of Refraction: 1.552
    Molar Refractivity: 73.6±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.86
    ACD/LogD (pH 5.5): 2.21
    ACD/BCF (pH 5.5): 28.33
    ACD/KOC (pH 5.5): 381.21
    ACD/LogD (pH 7.4): 2.21
    ACD/BCF (pH 7.4): 28.33
    ACD/KOC (pH 7.4): 381.16
    Polar Surface Area: 71 Å2
    Polarizability: 29.2±0.5 10-24cm3
    Surface Tension: 49.0±5.0 dyne/cm
    Molar Volume: 230.2±5.0 cm3

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