ChemSpider 2D Image | 7-Methoxy-3-(trifluoromethyl)-2H-chromen-2-one | C11H7F3O3

7-Methoxy-3-(trifluoromethyl)-2H-chromen-2-one

  • Molecular FormulaC11H7F3O3
  • Average mass244.167 Da
  • Monoisotopic mass244.034729 Da
  • ChemSpider ID72385461

More details:

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

2H-1-Benzopyran-2-one, 7-methoxy-3-(trifluoromethyl)- [ACD/Index Name]
7-Methoxy-3-(trifluormethyl)-2H-chromen-2-on [German] [ACD/IUPAC Name]
7-Methoxy-3-(trifluoromethyl)-2H-chromen-2-one [ACD/IUPAC Name]
7-Méthoxy-3-(trifluorométhyl)-2H-chromén-2-one [French] [ACD/IUPAC Name]
1562426-78-1 [RN]
MFCD31556323

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 287.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.7±3.0 kJ/mol
    Flash Point: 123.6±22.2 °C
    Index of Refraction: 1.507
    Molar Refractivity: 51.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 2.99
    ACD/BCF (pH 5.5): 111.27
    ACD/KOC (pH 5.5): 1014.85
    ACD/LogD (pH 7.4): 2.99
    ACD/BCF (pH 7.4): 111.27
    ACD/KOC (pH 7.4): 1014.85
    Polar Surface Area: 36 Å2
    Polarizability: 20.3±0.5 10-24cm3
    Surface Tension: 36.9±3.0 dyne/cm
    Molar Volume: 172.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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