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Bolling_Point:
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160 °C(lit.)
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|
Vapor_Pressure:
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0.152mmHg at 25°C
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LogP:
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3.06440
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More_Info:
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['1 . Appearance Yellow Liquid ', '2 . Density（g/mL,20℃）1479 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）160 ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexn20/D 1482 ', '8 . Flash point（ºC）794 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Insoluble in Water ']
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Computational_Chemistry:
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['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :3 ', '6. TPSA 202 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :159 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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Exact_Mass:
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195.99000
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MF:
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C7H4ClF3O
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|
Density:
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1.479 g/mL at 25 °C(lit.)
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Refractive_Index:
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n20/D 1.482(lit.)
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PSA:
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20.23000
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Flash_Point:
|
175 °F
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Molecular_Structure:
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['1. Molar refractive index 38 ', '2. Molar volume 1333 ', '3. Parachor （902K）3153 ', '4. Surface tension 313 ', '5. Dielectric constant N/A ', '6. Polarizability 1506 ', '7. Single isotope mass 195990277 Da ', '8. Nominal mass 196 Da ', '9. Average mass 1965543 Da']
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FW:
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196.55400
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