ChemSpider 2D Image | 3-Bromo-8-(trifluoromethyl)quinoline | C10H5BrF3N

3-Bromo-8-(trifluoromethyl)quinoline

  • Molecular FormulaC10H5BrF3N
  • Average mass276.053 Da
  • Monoisotopic mass274.955750 Da
  • ChemSpider ID29364756

More details:

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

1059064-11-7 [RN]
3-Brom-8-(trifluormethyl)chinolin [German] [ACD/IUPAC Name]
3-Bromo-8-(trifluorométhyl)quinoléine [French] [ACD/IUPAC Name]
3-Bromo-8-(trifluoromethyl)quinoline [ACD/IUPAC Name]
Quinoline, 3-bromo-8-(trifluoromethyl)- [ACD/Index Name]
113508-12-6 [RN]
MFCD25542362

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: 1.7±0.1 g/cm3
    Boiling Point: 284.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.2±3.0 kJ/mol
    Flash Point: 125.5±25.9 °C
    Index of Refraction: 1.573
    Molar Refractivity: 54.9±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.45
    ACD/LogD (pH 5.5): 3.51
    ACD/BCF (pH 5.5): 273.12
    ACD/KOC (pH 5.5): 1929.95
    ACD/LogD (pH 7.4): 3.51
    ACD/BCF (pH 7.4): 273.12
    ACD/KOC (pH 7.4): 1929.96
    Polar Surface Area: 13 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 37.9±3.0 dyne/cm
    Molar Volume: 166.5±3.0 cm3

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