ChemSpider 2D Image | 3-Methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl 4-aminobenzoate | C18H13NO4

3-Methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl 4-aminobenzoate

  • Molecular FormulaC18H13NO4
  • Average mass307.300 Da
  • Monoisotopic mass307.084473 Da
  • ChemSpider ID21118378

More details:

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

1,4-Naphthalenedione, 2-[(4-aminobenzoyl)oxy]-3-methyl- [ACD/Index Name]
3-Methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl 4-aminobenzoate [ACD/IUPAC Name]
4-Aminobenzoate de 3-méthyl-1,4-dioxo-1,4-dihydro-2-naphtalényle [French] [ACD/IUPAC Name]
1147564-13-3 [RN]
3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl 4-aminobenzoate
3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl 4-aminobenzoate(WXG00551)

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 516.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.8±3.0 kJ/mol
    Flash Point: 248.2±26.4 °C
    Index of Refraction: 1.662
    Molar Refractivity: 82.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.37
    ACD/LogD (pH 5.5): 2.72
    ACD/BCF (pH 5.5): 68.46
    ACD/KOC (pH 5.5): 716.80
    ACD/LogD (pH 7.4): 2.72
    ACD/BCF (pH 7.4): 68.48
    ACD/KOC (pH 7.4): 716.98
    Polar Surface Area: 86 Å2
    Polarizability: 32.6±0.5 10-24cm3
    Surface Tension: 64.4±5.0 dyne/cm
    Molar Volume: 222.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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