ChemSpider 2D Image | 1-Ethynyl-2-(trifluoromethoxy)benzene | C9H5F3O

1-Ethynyl-2-(trifluoromethoxy)benzene

  • Molecular FormulaC9H5F3O
  • Average mass186.131 Da
  • Monoisotopic mass186.029251 Da
  • ChemSpider ID21374336

More details:

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

1-Ethinyl-2-(trifluormethoxy)benzol [German] [ACD/IUPAC Name]
1-Ethynyl-2-(trifluoromethoxy)benzene [ACD/IUPAC Name]
1-Éthynyl-2-(trifluorométhoxy)benzène [French] [ACD/IUPAC Name]
2-Ethynylphenyl trifluoromethyl ether
886363-40-2 [RN]
Benzene, 1-ethynyl-2-(trifluoromethoxy)- [ACD/Index Name]
[886363-40-2] [RN]
1-Ethynyl-2-(trifluoromethoxy)benzene, 2-Ethynylphenyl trifluoromethyl ether
1-Ethynyl-2-(trifluoromethoxy)benzene; 2-Ethynylphenyl trifluoromethyl ether
1-Ethynyl-2-trifluoromethoxy-benzene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 166.8±40.0 °C at 760 mmHg
    Vapour Pressure: 2.3±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 38.7±3.0 kJ/mol
    Flash Point: 60.8±23.2 °C
    Index of Refraction: 1.467
    Molar Refractivity: 40.5±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.35
    ACD/LogD (pH 5.5): 3.03
    ACD/BCF (pH 5.5): 118.59
    ACD/KOC (pH 5.5): 1062.22
    ACD/LogD (pH 7.4): 3.03
    ACD/BCF (pH 7.4): 118.59
    ACD/KOC (pH 7.4): 1062.22
    Polar Surface Area: 9 Å2
    Polarizability: 16.1±0.5 10-24cm3
    Surface Tension: 31.2±5.0 dyne/cm
    Molar Volume: 146.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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