ChemSpider 2D Image | Ethyl 4-[benzyl(methyl)amino]butanoate | C14H21NO2

Ethyl 4-[benzyl(methyl)amino]butanoate

  • Molecular FormulaC14H21NO2
  • Average mass235.322 Da
  • Monoisotopic mass235.157227 Da
  • ChemSpider ID53624446

More details:

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

4-[Benzyl(méthyl)amino]butanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 4-[methyl(phenylmethyl)amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-[benzyl(methyl)amino]butanoate [ACD/IUPAC Name]
Ethyl-4-[benzyl(methyl)amino]butanoat [German] [ACD/IUPAC Name]
769121-22-4 [RN]
903170-13-8 [RN]
Ethyl 4-(benzyl(methyl)amino)butanoate
MFCD20129987

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 312.1±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.3±3.0 kJ/mol
    Flash Point: 104.2±14.0 °C
    Index of Refraction: 1.507
    Molar Refractivity: 69.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.00
    ACD/LogD (pH 5.5): 0.08
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.50
    ACD/LogD (pH 7.4): 1.71
    ACD/BCF (pH 7.4): 6.42
    ACD/KOC (pH 7.4): 64.65
    Polar Surface Area: 30 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 37.2±3.0 dyne/cm
    Molar Volume: 232.0±3.0 cm3

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