ChemSpider 2D Image | 4-Nitro-2-trifluoromethylacetophenone | C9H6F3NO3

4-Nitro-2-trifluoromethylacetophenone

  • Molecular FormulaC9H6F3NO3
  • Average mass233.144 Da
  • Monoisotopic mass233.029984 Da
  • ChemSpider ID24583720

More details:

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

1-[4-Nitro-2-(trifluormethyl)phenyl]ethanon [German] [ACD/IUPAC Name]
1-[4-NITRO-2-(TRIFLUOROMETHYL)PHENYL]ETHAN-1-ONE
1-[4-Nitro-2-(trifluoromethyl)phenyl]ethanone [ACD/IUPAC Name]
1-[4-Nitro-2-(trifluorométhyl)phényl]éthanone [French] [ACD/IUPAC Name]
1314777-65-5 [RN]
4-Nitro-2-trifluoromethylacetophenone
77344-68-4 [RN]
Ethanone, 1-[4-nitro-2-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-(4-Nitro-2-(trifluoromethyl)phenyl)ethanone
4'-Nitro-2'-(trifluoromethyl)acetophenone
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 274.7±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.3±3.0 kJ/mol
    Flash Point: 119.9±27.3 °C
    Index of Refraction: 1.487
    Molar Refractivity: 47.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): 2.50
    ACD/BCF (pH 5.5): 46.41
    ACD/KOC (pH 5.5): 542.75
    ACD/LogD (pH 7.4): 2.50
    ACD/BCF (pH 7.4): 46.41
    ACD/KOC (pH 7.4): 542.75
    Polar Surface Area: 63 Å2
    Polarizability: 19.0±0.5 10-24cm3
    Surface Tension: 35.2±3.0 dyne/cm
    Molar Volume: 166.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement