ChemSpider 2D Image | (5-Nitro-2-pyridinyl)malonic acid | C8H6N2O6

(5-Nitro-2-pyridinyl)malonic acid

  • Molecular FormulaC8H6N2O6
  • Average mass226.143 Da
  • Monoisotopic mass226.022583 Da
  • ChemSpider ID24597979

More details:

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

(5-Nitro-2-pyridinyl)malonic acid [ACD/IUPAC Name]
(5-Nitro-2-pyridinyl)malonsäure [German] [ACD/IUPAC Name]
(5-Nitropyridin-2-yl)malonic acid
Acide (5-nitro-2-pyridinyl)malonique [French] [ACD/IUPAC Name]
Propanedioic acid, 2-(5-nitro-2-pyridinyl)- [ACD/Index Name]
(5-Nitro-2-pyridinyl)propanedioic acid
(5-Nitropyridin-2-yl)propanedioic acid
131189-22-5 [RN]
2-(5-Nitropyridin-2-yl)malonic acid
2-(5-NITROPYRIDIN-2-YL)PROPANEDIOIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 480.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.5±3.0 kJ/mol
    Flash Point: 244.3±28.7 °C
    Index of Refraction: 1.640
    Molar Refractivity: 48.2±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.21
    ACD/LogD (pH 5.5): -3.61
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.59
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 133 Å2
    Polarizability: 19.1±0.5 10-24cm3
    Surface Tension: 93.0±3.0 dyne/cm
    Molar Volume: 133.8±3.0 cm3

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