ChemSpider 2D Image | tert-Butyl 4-(1-cyanopropylidene)piperidine-1-carboxylate | C14H22N2O2

tert-Butyl 4-(1-cyanopropylidene)piperidine-1-carboxylate

  • Molecular FormulaC14H22N2O2
  • Average mass250.337 Da
  • Monoisotopic mass250.168121 Da
  • ChemSpider ID26232027

More details:

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

1,1-Dimethylethyl 4-(1-cyanopropylidene)-1-piperidinecarboxylate
1198283-75-8 [RN]
1-Piperidinecarboxylic acid, 4-(1-cyanopropylidene)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(1-cyanopropylidene)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(1-cyanpropyliden)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-(1-Cyanopropylidène)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-(1-cyanopropylidene)piperidine-1-carboxylate
[1198283-75-8] [RN]
119828-37-4 [RN]
MFCD12026389 [MDL number]
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 368.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.4±25.9 °C
    Index of Refraction: 1.499
    Molar Refractivity: 69.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.66
    ACD/LogD (pH 5.5): 3.32
    ACD/BCF (pH 5.5): 197.35
    ACD/KOC (pH 5.5): 1529.45
    ACD/LogD (pH 7.4): 3.32
    ACD/BCF (pH 7.4): 197.35
    ACD/KOC (pH 7.4): 1529.45
    Polar Surface Area: 53 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 41.1±3.0 dyne/cm
    Molar Volume: 236.5±3.0 cm3

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