ChemSpider 2D Image | Methyl 2-chloro-6-methoxy-3-nitrobenzoate | C9H8ClNO5

Methyl 2-chloro-6-methoxy-3-nitrobenzoate

  • Molecular FormulaC9H8ClNO5
  • Average mass245.617 Da
  • Monoisotopic mass245.009094 Da
  • ChemSpider ID57421413

More details:

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

2-Chloro-6-méthoxy-3-nitrobenzoate de méthyle [French] [ACD/IUPAC Name]
55776-21-1 [RN]
Benzoic acid, 2-chloro-6-methoxy-3-nitro-, methyl ester [ACD/Index Name]
Methyl 2-chloro-6-methoxy-3-nitrobenzoate [ACD/IUPAC Name]
Methyl-2-chlor-6-methoxy-3-nitrobenzoat [German] [ACD/IUPAC Name]
MFCD30185868

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 383.1±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.2±3.0 kJ/mol
    Flash Point: 185.5±26.5 °C
    Index of Refraction: 1.554
    Molar Refractivity: 56.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.14
    ACD/LogD (pH 5.5): 2.46
    ACD/BCF (pH 5.5): 43.87
    ACD/KOC (pH 5.5): 521.28
    ACD/LogD (pH 7.4): 2.46
    ACD/BCF (pH 7.4): 43.87
    ACD/KOC (pH 7.4): 521.28
    Polar Surface Area: 81 Å2
    Polarizability: 22.3±0.5 10-24cm3
    Surface Tension: 47.7±3.0 dyne/cm
    Molar Volume: 175.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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