ChemSpider 2D Image | Methyl 3-(benzyloxy)-4-nitrobenzoate | C15H13NO5

Methyl 3-(benzyloxy)-4-nitrobenzoate

  • Molecular FormulaC15H13NO5
  • Average mass287.267 Da
  • Monoisotopic mass287.079376 Da
  • ChemSpider ID24603357

More details:

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

3-(Benzyloxy)-4-nitrobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-nitro-3-(phenylmethoxy)-, methyl ester [ACD/Index Name]
Methyl 3-(benzyloxy)-4-nitrobenzoate [ACD/IUPAC Name]
Methyl-3-(benzyloxy)-4-nitrobenzoat [German] [ACD/IUPAC Name]
[209528-69-8] [RN]
2-(Benzyloxy)-4-(methoxycarbonyl)nitrobenzene
209528-69-8 [RN]
3-benzyloxy-4-nitro-benzoic acid methyl ester
AGN-PC-003JRJ
CTK6I9783
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 455.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.5±3.0 kJ/mol
    Flash Point: 199.3±27.9 °C
    Index of Refraction: 1.592
    Molar Refractivity: 75.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.21
    ACD/LogD (pH 5.5): 3.81
    ACD/BCF (pH 5.5): 460.73
    ACD/KOC (pH 5.5): 2806.05
    ACD/LogD (pH 7.4): 3.81
    ACD/BCF (pH 7.4): 460.73
    ACD/KOC (pH 7.4): 2806.05
    Polar Surface Area: 81 Å2
    Polarizability: 30.0±0.5 10-24cm3
    Surface Tension: 50.4±3.0 dyne/cm
    Molar Volume: 223.9±3.0 cm3

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