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Refractive_Index:
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n20/D 1.526(lit.)
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Vapor_Pressure:
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0.25mmHg at 25°C
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Flash_Point:
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181 °F
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LogP:
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3.62710
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Bolling_Point:
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91-92 °C9 mm Hg(lit.)
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More_Info:
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['1 . Appearance Colourless Liquid 2 . Density（ g/mL, 25/4 ℃） 0875 3 . Relative vapor density（ g/mL, Atmosphere =1 ） 46 ', '4 . Melting point（ºC）-38 ', '5 . Boiling point（ºC,Atmospheric pressure）219 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index（ 20 ℃ ）15250 ', '8 . Flash point（ºC）80 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）80 ', '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 294 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 不溶解']
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Molecular_Structure:
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['1 . Molar refractive index 5556 ', '2 . Molar volume （m3/mol）1820 ', '3 . Parachor （902K）4202 ', '4 . Surface tension 283 ', '5 . Dielectric constant （F/m）233 ', '6 . Polarizability （10 -24cm 3）2202']
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Computational_Chemistry:
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['1. XlogP :44 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :142 ', '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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Melting_Point:
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-38°C
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MF:
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C12H16
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Exact_Mass:
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160.12500
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FW:
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160.25500
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Density:
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0.875 g/mL at 25 °C(lit.)
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