ChemSpider 2D Image | 5-Bromo-2-butoxybenzoyl chloride | C11H12BrClO2

5-Bromo-2-butoxybenzoyl chloride

  • Molecular FormulaC11H12BrClO2
  • Average mass291.569 Da
  • Monoisotopic mass289.970917 Da
  • ChemSpider ID23079390

More details:

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

5-Brom-2-butoxybenzoylchlorid [German] [ACD/IUPAC Name]
5-Bromo-2-butoxybenzoyl chloride [ACD/IUPAC Name]
Benzoyl chloride, 5-bromo-2-butoxy- [ACD/Index Name]
Chlorure de 5-bromo-2-butoxybenzoyle [French] [ACD/IUPAC Name]
343949-22-4 [RN]
5-bromo-2-butoxybenzoyl chloride|benzoyl chloride, 5-bromo-2-butoxy-
MFCD12197931 [MDL number]
VS-13889

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 354.8±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.0±3.0 kJ/mol
    Flash Point: 168.4±23.7 °C
    Index of Refraction: 1.543
    Molar Refractivity: 64.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.77
    ACD/LogD (pH 5.5): 4.40
    ACD/BCF (pH 5.5): 1302.08
    ACD/KOC (pH 5.5): 5902.78
    ACD/LogD (pH 7.4): 4.40
    ACD/BCF (pH 7.4): 1302.08
    ACD/KOC (pH 7.4): 5902.78
    Polar Surface Area: 26 Å2
    Polarizability: 25.7±0.5 10-24cm3
    Surface Tension: 40.2±3.0 dyne/cm
    Molar Volume: 205.5±3.0 cm3

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