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Molecular_Structure:
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['1 . Molar refractive index 4086 ', '2 . Molar volume （m3/mol）1223 ', '3 . Parachor （902K）3270 ', '4 . Surface tension 510 ', '5 . Dielectric constant 不可用 ', '6 偶极距（10 -24cm 3）不可用 ', '7 . Polarizability 1620']
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Flash_Point:
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139.2±23.7 °C
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Refractive_Index:
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1.583
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FW:
|
219.008
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Density:
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1.8±0.1 g/cm3
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Bolling_Point:
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306.6±27.0 °C at 760 mmHg
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Computational_Chemistry:
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['1. XlogP :22 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :163 ', '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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LogP:
|
2.80
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|
Melting_Point:
|
138-140 °C(lit.)
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PSA:
|
37.30000
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MF:
|
C7H4BrFO2
|
|
More_Info:
|
['1 . Appearance White 结晶粉末。 ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）138-140 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,12mm）Unknow ', '7 . Refractive index（n 20/D ）Unknow 8 . Flash point（ ºF ） Unknow 9 . Specific rotation（ º ） Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）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 Unknow']
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|
Vapor_Pressure:
|
0.0±0.7 mmHg at 25°C
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|
Exact_Mass:
|
217.937866
|
