ChemSpider 2D Image | 4-[2-(Hydroxymethyl)-1H-benzimidazol-1-yl]butyl pivalate | C17H24N2O3

4-[2-(Hydroxymethyl)-1H-benzimidazol-1-yl]butyl pivalate

  • Molecular FormulaC17H24N2O3
  • Average mass304.384 Da
  • Monoisotopic mass304.178680 Da
  • ChemSpider ID26403652

More details:

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

4-[2-(Hydroxymethyl)-1H-benzimidazol-1-yl]butyl 2,2-dimethylpropanoate
4-[2-(Hydroxymethyl)-1H-benzimidazol-1-yl]butyl pivalate [ACD/IUPAC Name]
4-[2-(Hydroxymethyl)-1H-benzimidazol-1-yl]butylpivalat [German] [ACD/IUPAC Name]
797032-02-1 [RN]
Pivalate de 4-[2-(hydroxyméthyl)-1H-benzimidazol-1-yl]butyle [French] [ACD/IUPAC Name]
Propanoic acid, 2,2-dimethyl-, 4-[2-(hydroxymethyl)-1H-benzimidazol-1-yl]butyl ester [ACD/Index Name]
[797032-02-1] [RN]
4-(2-(Hydroxymethyl)-1H-benzo[d]imidazol-1-yl)butyl pivalate
4-[2-(Hydroxymethyl)-1H-benzoimidazol-1-yl]butyl Pivalate
4-[2-(hydroxymethyl)benzimidazol-1-yl]butyl 2,2-dimethylpropanoate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 471.4±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.3±3.0 kJ/mol
    Flash Point: 238.9±24.6 °C
    Index of Refraction: 1.552
    Molar Refractivity: 85.9±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.21
    ACD/LogD (pH 5.5): 2.85
    ACD/BCF (pH 5.5): 82.88
    ACD/KOC (pH 5.5): 777.13
    ACD/LogD (pH 7.4): 2.94
    ACD/BCF (pH 7.4): 100.69
    ACD/KOC (pH 7.4): 944.07
    Polar Surface Area: 64 Å2
    Polarizability: 34.0±0.5 10-24cm3
    Surface Tension: 40.6±7.0 dyne/cm
    Molar Volume: 268.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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