ChemSpider 2D Image | Ethyl 2-(benzylamino)-5-chloronicotinate | C15H15ClN2O2

Ethyl 2-(benzylamino)-5-chloronicotinate

  • Molecular FormulaC15H15ClN2O2
  • Average mass290.745 Da
  • Monoisotopic mass290.082214 Da
  • ChemSpider ID24765152

More details:

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

1186405-01-5 [RN]
2-(Benzylamino)-5-chloronicotinate d'éthyle [French] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 5-chloro-2-[(phenylmethyl)amino]-, ethyl ester [ACD/Index Name]
Ethyl 2-(benzylamino)-5-chloronicotinate [ACD/IUPAC Name]
Ethyl 5-chloro-2-[(phenylmethyl)amino]-3-pyridinecarboxylate
Ethyl-2-(benzylamino)-5-chlornicotinat [German] [ACD/IUPAC Name]
Ethyl 2-(benzylamino)-5-chloropyridine-3-carboxylate
ethylbenzylaminochloronicotinate
HD-0026
MFCD12827827 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 413.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.6±3.0 kJ/mol
    Flash Point: 203.7±27.3 °C
    Index of Refraction: 1.613
    Molar Refractivity: 79.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 5.50
    ACD/LogD (pH 5.5): 4.68
    ACD/BCF (pH 5.5): 2101.05
    ACD/KOC (pH 5.5): 8305.46
    ACD/LogD (pH 7.4): 4.68
    ACD/BCF (pH 7.4): 2108.33
    ACD/KOC (pH 7.4): 8334.25
    Polar Surface Area: 51 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 51.2±3.0 dyne/cm
    Molar Volume: 229.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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