ChemSpider 2D Image | [3-(Trifluoromethyl)phenyl]acetaldehyde | C9H7F3O

[3-(Trifluoromethyl)phenyl]acetaldehyde

  • Molecular FormulaC9H7F3O
  • Average mass188.146 Da
  • Monoisotopic mass188.044907 Da
  • ChemSpider ID11535402

More details:

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

[3-(Trifluormethyl)phenyl]acetaldehyd [German] [ACD/IUPAC Name]
[3-(Trifluoromethyl)phenyl]acetaldehyde [ACD/IUPAC Name]
[3-(Trifluorométhyl)phényl]acétaldéhyde [French] [ACD/IUPAC Name]
2-(3-(trifluoromethyl)phenyl)acetaldehyde
21172-31-6 [RN]
Benzeneacetaldehyde, 3-(trifluoromethyl)- [ACD/Index Name]
MFCD08703365 [MDL number]
(3-trifluoromethyl-phenyl)-acetaldehyde
(3-Trifluoromethylphenyl)acetaldehyde
2-[3-(trifluoromethyl)phenyl]acetaldehyde
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 199.5±35.0 °C at 760 mmHg
    Vapour Pressure: 0.3±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 43.6±3.0 kJ/mol
    Flash Point: 79.8±17.4 °C
    Index of Refraction: 1.448
    Molar Refractivity: 41.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.35
    ACD/LogD (pH 5.5): 2.38
    ACD/BCF (pH 5.5): 38.01
    ACD/KOC (pH 5.5): 470.43
    ACD/LogD (pH 7.4): 2.38
    ACD/BCF (pH 7.4): 38.01
    ACD/KOC (pH 7.4): 470.43
    Polar Surface Area: 17 Å2
    Polarizability: 16.2±0.5 10-24cm3
    Surface Tension: 27.3±3.0 dyne/cm
    Molar Volume: 153.1±3.0 cm3

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