ChemSpider 2D Image | Ethyl 2-(benzylamino)-5-iodonicotinate | C15H15IN2O2

Ethyl 2-(benzylamino)-5-iodonicotinate

  • Molecular FormulaC15H15IN2O2
  • Average mass382.196 Da
  • Monoisotopic mass382.017822 Da
  • ChemSpider ID25073178

More details:

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

1190198-19-6 [RN]
2-(Benzylamino)-5-iodonicotinate d'éthyle [French] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 5-iodo-2-[(phenylmethyl)amino]-, ethyl ester [ACD/Index Name]
Ethyl 2-(benzylamino)-5-iodonicotinate [ACD/IUPAC Name]
Ethyl 5-iodo-2-[(phenylmethyl)amino]-3-pyridinecarboxylate
Ethyl-2-(benzylamino)-5-iodnicotinat [German] [ACD/IUPAC Name]
95%
ethyl 2-(benzylamino)-5-iodopyridine-3-carboxylate
ethylbenzylaminoiodonicotinate
KD-0057
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 441.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.8±3.0 kJ/mol
    Flash Point: 220.6±28.7 °C
    Index of Refraction: 1.654
    Molar Refractivity: 87.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 5.96
    ACD/LogD (pH 5.5): 4.79
    ACD/BCF (pH 5.5): 2579.79
    ACD/KOC (pH 5.5): 9616.10
    ACD/LogD (pH 7.4): 4.79
    ACD/BCF (pH 7.4): 2592.40
    ACD/KOC (pH 7.4): 9663.09
    Polar Surface Area: 51 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 55.4±3.0 dyne/cm
    Molar Volume: 239.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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