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

3-Bromo-2-(trifluoromethyl)quinoline

  • Molecular FormulaC10H5BrF3N
  • Average mass276.053 Da
  • Monoisotopic mass274.955750 Da
  • ChemSpider ID32864252

More details:

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

1620749-79-2 [RN]
3-Brom-2-(trifluormethyl)chinolin [German] [ACD/IUPAC Name]
3-Bromo-2-(trifluorométhyl)quinoléine [French] [ACD/IUPAC Name]
3-Bromo-2-(trifluoromethyl)quinoline [ACD/IUPAC Name]
Quinoline, 3-bromo-2-(trifluoromethyl)- [ACD/Index Name]
MFCD27991307

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: 262.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.0±3.0 kJ/mol
    Flash Point: 112.6±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: 3.89
    ACD/LogD (pH 5.5): 3.74
    ACD/BCF (pH 5.5): 412.14
    ACD/KOC (pH 5.5): 2590.90
    ACD/LogD (pH 7.4): 3.74
    ACD/BCF (pH 7.4): 412.14
    ACD/KOC (pH 7.4): 2590.90
    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

    Click to predict properties on the Chemicalize site


    Advertisement