ChemSpider 2D Image | 4-(Benzyloxy)-3-methoxy-5-nitrobenzoic acid | C15H13NO6

4-(Benzyloxy)-3-methoxy-5-nitrobenzoic acid

  • Molecular FormulaC15H13NO6
  • Average mass303.267 Da
  • Monoisotopic mass303.074280 Da
  • ChemSpider ID24765133

More details:

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

214848-09-6 [RN]
4-(Benzyloxy)-3-methoxy-5-nitrobenzoesäure [German] [ACD/IUPAC Name]
4-(Benzyloxy)-3-methoxy-5-nitrobenzoic acid [ACD/IUPAC Name]
Acide 4-(benzyloxy)-3-méthoxy-5-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-methoxy-5-nitro-4-(phenylmethoxy)- [ACD/Index Name]
2-(Benzyloxy)-5-carboxy-3-methoxynitrobenzene
2-(Benzyloxy)-5-carboxy-3-nitroanisole
2-(Benzyloxy)-5-carboxy-3-nitroanisole, 2-(Benzyloxy)-5-carboxy-3-methoxynitrobenzene
2-(Benzyloxy)-5-carboxy-3-nitroanisole; 2-(Benzyloxy)-5-carboxy-3-methoxynitrobenzene
4-(benzyloxy)-3-methoxy-5-nitrobenzenecarboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 496.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.5±3.0 kJ/mol
    Flash Point: 254.0±28.7 °C
    Index of Refraction: 1.614
    Molar Refractivity: 77.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.75
    ACD/LogD (pH 5.5): 1.47
    ACD/BCF (pH 5.5): 2.91
    ACD/KOC (pH 5.5): 23.45
    ACD/LogD (pH 7.4): 0.21
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.27
    Polar Surface Area: 102 Å2
    Polarizability: 30.8±0.5 10-24cm3
    Surface Tension: 56.6±3.0 dyne/cm
    Molar Volume: 222.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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