ChemSpider 2D Image | MFCD21332876 | C18H26N4O2

MFCD21332876

  • Molecular FormulaC18H26N4O2
  • Average mass330.425 Da
  • Monoisotopic mass330.205566 Da
  • ChemSpider ID29408625

More details:

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

1-Piperidinecarboxylic acid, 4-[2-(aminomethyl)-1H-benzimidazol-1-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[2-(aminomethyl)-1H-benzimidazol-1-yl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[2-(aminomethyl)-1H-benzimidazol-1-yl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[2-(Aminométhyl)-1H-benzimidazol-1-yl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
876589-26-3 [RN]
MFCD21332876
tert-butyl 4-(2-(aminomethyl)-1H-benzo[d]imidazol-1-yl)piperidine-1-carboxylate
tert-butyl 4-[2-(aminomethyl)-1H-1,3-benzodiazol-1-yl]piperidine-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: 503.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.3±3.0 kJ/mol
    Flash Point: 258.4±28.7 °C
    Index of Refraction: 1.615
    Molar Refractivity: 93.0±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.58
    ACD/LogD (pH 5.5): -0.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.40
    ACD/LogD (pH 7.4): 1.53
    ACD/BCF (pH 7.4): 5.54
    ACD/KOC (pH 7.4): 71.23
    Polar Surface Area: 73 Å2
    Polarizability: 36.8±0.5 10-24cm3
    Surface Tension: 46.9±7.0 dyne/cm
    Molar Volume: 266.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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