ChemSpider 2D Image | Methyl 2-(4-hydroxy-2-isoxazolidinyl)-5-nitrobenzoate | C11H12N2O6

Methyl 2-(4-hydroxy-2-isoxazolidinyl)-5-nitrobenzoate

  • Molecular FormulaC11H12N2O6
  • Average mass268.223 Da
  • Monoisotopic mass268.069550 Da
  • ChemSpider ID26052631

More details:

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

1242267-99-7 [RN]
2-(4-Hydroxy-1,2-oxazolidin-2-yl)-5-nitrobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-(4-hydroxy-2-isoxazolidinyl)-5-nitro-, methyl ester [ACD/Index Name]
Methyl 2-(4-hydroxy-1,2-oxazolidin-2-yl)-5-nitrobenzoate [ACD/IUPAC Name]
Methyl 2-(4-hydroxy-2-isoxazolidinyl)-5-nitrobenzoate
Methyl-2-(4-hydroxy-1,2-oxazolidin-2-yl)-5-nitrobenzoat [German] [ACD/IUPAC Name]
4-Hydroxy-2-[2-(methoxycarbonyl)-4-nitrophenyl]isoxazolidine
FE-0703
Methyl 2-(4-hydroxyisoxazolidin-2-yl)-5-nitrobenzoate
Methyl 2-[4-hydroxydihydro-2(3H)-isoxazolyl]-5-nitrobenzenecarboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 453.6±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.1±3.0 kJ/mol
    Flash Point: 228.1±31.5 °C
    Index of Refraction: 1.614
    Molar Refractivity: 63.4±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.37
    ACD/LogD (pH 5.5): 0.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 30.71
    ACD/LogD (pH 7.4): 0.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.71
    Polar Surface Area: 105 Å2
    Polarizability: 25.1±0.5 10-24cm3
    Surface Tension: 65.4±3.0 dyne/cm
    Molar Volume: 181.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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