ChemSpider 2D Image | 5-Bromo-2-(4-chlorophenyl)pentanoic acid | C11H12BrClO2

5-Bromo-2-(4-chlorophenyl)pentanoic acid

  • Molecular FormulaC11H12BrClO2
  • Average mass291.569 Da
  • Monoisotopic mass289.970917 Da
  • ChemSpider ID22547864

More details:






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

5-Brom-2-(4-chlorphenyl)pentansäure [German] [ACD/IUPAC Name]
5-Bromo-2-(4-chlorophenyl)pentanoic acid [ACD/IUPAC Name]
Acide 5-bromo-2-(4-chlorophényl)pentanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-(3-bromopropyl)-4-chloro- [ACD/Index Name]
[1017789-33-1] [RN]
1017789-33-1 [RN]
2-(Dimethylamino)butyric Acid
5464-04-0 [RN]
5-bromo-2-(4-chlorophenyl)-pentanoic acid
5-bromo-2-(4-chloro-phenyl)-pentanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 395.8±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.1±3.0 kJ/mol
    Flash Point: 193.2±26.5 °C
    Index of Refraction: 1.579
    Molar Refractivity: 63.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.65
    ACD/LogD (pH 5.5): 2.27
    ACD/BCF (pH 5.5): 13.92
    ACD/KOC (pH 5.5): 88.53
    ACD/LogD (pH 7.4): 0.52
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.60
    Polar Surface Area: 37 Å2
    Polarizability: 25.3±0.5 10-24cm3
    Surface Tension: 50.2±3.0 dyne/cm
    Molar Volume: 192.3±3.0 cm3

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