ChemSpider 2D Image | Ethyl 3-bromo-4-ethylbenzoate | C11H13BrO2

Ethyl 3-bromo-4-ethylbenzoate

  • Molecular FormulaC11H13BrO2
  • Average mass257.124 Da
  • Monoisotopic mass256.009888 Da
  • ChemSpider ID23960194

More details:

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

3-Bromo-4-éthylbenzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-4-ethyl-, ethyl ester [ACD/Index Name]
Ethyl 3-bromo-4-ethylbenzoate [ACD/IUPAC Name]
Ethyl-3-brom-4-ethylbenzoat [German] [ACD/IUPAC Name]
1131615-08-1 [RN]
3-bromo-4-ethylbenzoic acid ethyl ester
ethyl 3-bromanyl-4-ethyl-benzoate
Ethyl 3-bromo-4-ethylbenzoate; 3-Bromo-4-ethylbenzoic acid ethyl ester
ETHYL 3-BROMO-4-ETHYLBENZOATE|ETHYL 3-BROMO-4-ETHYLBENZOATE
ethyl3-bromo-4-ethylbenzoate
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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: 306.8±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.7±3.0 kJ/mol
    Flash Point: 139.3±24.6 °C
    Index of Refraction: 1.534
    Molar Refractivity: 59.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.40
    ACD/LogD (pH 5.5): 3.92
    ACD/BCF (pH 5.5): 565.50
    ACD/KOC (pH 5.5): 3249.34
    ACD/LogD (pH 7.4): 3.92
    ACD/BCF (pH 7.4): 565.50
    ACD/KOC (pH 7.4): 3249.34
    Polar Surface Area: 26 Å2
    Polarizability: 23.7±0.5 10-24cm3
    Surface Tension: 38.1±3.0 dyne/cm
    Molar Volume: 192.8±3.0 cm3

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