ChemSpider 2D Image | 4-((4-(Trifluoromethyl)pyrimidin-2-yl)oxy)benzoic acid | C12H7F3N2O3

4-((4-(Trifluoromethyl)pyrimidin-2-yl)oxy)benzoic acid

  • Molecular FormulaC12H7F3N2O3
  • Average mass284.191 Da
  • Monoisotopic mass284.040863 Da
  • ChemSpider ID21469809

More details:

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

4-((4-(Trifluoromethyl)pyrimidin-2-yl)oxy)benzoic acid
4-{[4-(Trifluormethyl)-2-pyrimidinyl]oxy}benzoesäure [German] [ACD/IUPAC Name]
4-{[4-(Trifluoromethyl)-2-pyrimidinyl]oxy}benzoic acid [ACD/IUPAC Name]
914636-59-2 [RN]
Acide 4-{[4-(trifluorométhyl)-2-pyrimidinyl]oxy}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[4-(trifluoromethyl)-2-pyrimidinyl]oxy]- [ACD/Index Name]
[914636-59-2] [RN]
2-(4-Carboxyphenoxy)-4-(trifluoromethyl)pyrimidine
4-([4-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]OXY)BENZOIC ACID
4-[4-(trifluoromethyl)pyrimidin-2-yloxy]benzoic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 433.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.7±3.0 kJ/mol
    Flash Point: 216.1±31.5 °C
    Index of Refraction: 1.544
    Molar Refractivity: 60.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.43
    ACD/LogD (pH 5.5): 1.27
    ACD/BCF (pH 5.5): 2.38
    ACD/KOC (pH 5.5): 24.34
    ACD/LogD (pH 7.4): -0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 72 Å2
    Polarizability: 24.1±0.5 10-24cm3
    Surface Tension: 47.7±3.0 dyne/cm
    Molar Volume: 192.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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