ChemSpider 2D Image | 4-Morpholin-4-yl-2-nitrobenzoic acid | C11H12N2O5

4-Morpholin-4-yl-2-nitrobenzoic acid

  • Molecular FormulaC11H12N2O5
  • Average mass252.223 Da
  • Monoisotopic mass252.074615 Da
  • ChemSpider ID24765184

More details:

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

4-(4-Morpholinyl)-2-nitrobenzoesäure [German] [ACD/IUPAC Name]
4-(4-Morpholinyl)-2-nitrobenzoic acid [ACD/IUPAC Name]
404010-98-6 [RN]
4-Morpholin-4-yl-2-nitrobenzoic acid
Acide 4-(4-morpholinyl)-2-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-morpholinyl)-2-nitro- [ACD/Index Name]
[404010-98-6] [RN]
4-(Morpholin-4-yl)-2-nitrobenzoic acid
4-morpholino-2-nitro-benzoic acid
4-Morpholino-2-nitrobenzoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 486.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.2±3.0 kJ/mol
    Flash Point: 247.8±28.7 °C
    Index of Refraction: 1.612
    Molar Refractivity: 61.5±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.38
    ACD/LogD (pH 5.5): -0.98
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.53
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 96 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 62.8±3.0 dyne/cm
    Molar Volume: 177.1±3.0 cm3

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