ChemSpider 2D Image | methyl 2-(methylamino)-5-nitro-pyridine-3-carboxylate | C8H9N3O4

methyl 2-(methylamino)-5-nitro-pyridine-3-carboxylate

  • Molecular FormulaC8H9N3O4
  • Average mass211.175 Da
  • Monoisotopic mass211.059311 Da
  • ChemSpider ID26052618

More details:

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

2-(Méthylamino)-5-nitronicotinate de méthyle [French] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 2-(methylamino)-5-nitro-, methyl ester [ACD/Index Name]
Methyl-2-(methylamino)-5-nitronicotinat [German] [ACD/IUPAC Name]
1228182-64-6 [RN]
EE-0711
Methyl 2-(methylamino)-5-nitronicotinate [ACD/IUPAC Name]
methyl 2-(methylamino)-5-nitropyridine-3-carboxylate
methylmethylaminonitronicotinate
MFCD16622796 [MDL number]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 339.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.3±3.0 kJ/mol
    Flash Point: 159.2±27.9 °C
    Index of Refraction: 1.605
    Molar Refractivity: 52.3±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.79
    ACD/LogD (pH 5.5): 2.13
    ACD/BCF (pH 5.5): 24.59
    ACD/KOC (pH 5.5): 344.43
    ACD/LogD (pH 7.4): 2.13
    ACD/BCF (pH 7.4): 24.59
    ACD/KOC (pH 7.4): 344.45
    Polar Surface Area: 97 Å2
    Polarizability: 20.7±0.5 10-24cm3
    Surface Tension: 58.9±3.0 dyne/cm
    Molar Volume: 151.8±3.0 cm3

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