ChemSpider 2D Image | Methyl 4-phenyl-2-(trifluoromethyl)-1,3-oxazole-5-carboxylate | C12H8F3NO3

Methyl 4-phenyl-2-(trifluoromethyl)-1,3-oxazole-5-carboxylate

  • Molecular FormulaC12H8F3NO3
  • Average mass271.192 Da
  • Monoisotopic mass271.045624 Da
  • ChemSpider ID29357550

More details:

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

1346526-79-1 [RN]
4-Phényl-2-(trifluorométhyl)-1,3-oxazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Oxazolecarboxylic acid, 4-phenyl-2-(trifluoromethyl)-, methyl ester [ACD/Index Name]
Methyl 4-phenyl-2-(trifluoromethyl)-1,3-oxazole-5-carboxylate [ACD/IUPAC Name]
Methyl-4-phenyl-2-(trifluormethyl)-1,3-oxazol-5-carboxylat [German] [ACD/IUPAC Name]
95%
METHYL 4-PHENYL-2-(TRIFLUOROMETHYL)OXAZOLE-5-CARBOXYLATE
MFCD22573704

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 306.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.7±3.0 kJ/mol
    Flash Point: 139.4±27.9 °C
    Index of Refraction: 1.486
    Molar Refractivity: 58.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.62
    ACD/LogD (pH 5.5): 2.81
    ACD/BCF (pH 5.5): 80.17
    ACD/KOC (pH 5.5): 802.61
    ACD/LogD (pH 7.4): 2.81
    ACD/BCF (pH 7.4): 80.17
    ACD/KOC (pH 7.4): 802.61
    Polar Surface Area: 52 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 34.8±3.0 dyne/cm
    Molar Volume: 202.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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