ChemSpider 2D Image | Methyl 2-(1-piperidinylmethyl)benzoate | C14H19NO2

Methyl 2-(1-piperidinylmethyl)benzoate

  • Molecular FormulaC14H19NO2
  • Average mass233.306 Da
  • Monoisotopic mass233.141586 Da
  • ChemSpider ID21521330

More details:

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

2-(1-Pipéridinylméthyl)benzoate de méthyle [French] [ACD/IUPAC Name]
2-Piperidin-1-ylmethylbenzoic acid methyl ester
914347-17-4 [RN]
Benzoic acid, 2-(1-piperidinylmethyl)-, methyl ester [ACD/Index Name]
Methyl 2-(1-piperidinylmethyl)benzoate [ACD/IUPAC Name]
Methyl 2-(piperidin-1-ylmethyl)benzoate
Methyl-2-(1-piperidinylmethyl)benzoat [German] [ACD/IUPAC Name]
[914347-17-4] [RN]
2-Piperidin-1-ylmethyl benzoic acid methyl ester
73278-90-7 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 335.4±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.8±3.0 kJ/mol
    Flash Point: 121.4±14.0 °C
    Index of Refraction: 1.545
    Molar Refractivity: 67.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.73
    ACD/LogD (pH 5.5): 0.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.28
    ACD/LogD (pH 7.4): 1.59
    ACD/BCF (pH 7.4): 4.75
    ACD/KOC (pH 7.4): 46.44
    Polar Surface Area: 30 Å2
    Polarizability: 26.8±0.5 10-24cm3
    Surface Tension: 42.2±3.0 dyne/cm
    Molar Volume: 213.7±3.0 cm3

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