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Refractive_Index:
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n20/D 1.5390(lit.)
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Vapor_Pressure:
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0.027mmHg at 25°C
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Flash_Point:
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125 °F
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LogP:
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2.81440
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Bolling_Point:
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228-229 °C(lit.)
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FW:
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162.22800
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PSA:
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17.07000
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Computational_Chemistry:
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['1 . XlogP 27 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 171 ', '7 . Heavy Atom Count 12 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 174 ', '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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10-11 °C
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MF:
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C11H14O
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Exact_Mass:
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162.10400
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Molecular_Structure:
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['1. Molar refractive index 5075 ', '2. Molar volume 1697 ', '3. Parachor （902K）4053 ', '4. Surface tension 324 ', '5. Dielectric constant N/A ', '6. Polarizability 2012 ', '7. Single isotope mass 162104465Da ', '8. Nominal mass 162Da ', '9. Average mass 1622283Da']
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Density:
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0.975 g/mL at 25 °C(lit.)
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More_Info:
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['1 . Appearance Liquid ', '2 . Density（g/mL,20ºC）0986 ', '3 相对. Density（20℃，4℃）0986 ', '4 . Melting point（ºC）105 ', '5 . Boiling point（ºC）2465 ', '6 常温. Refractive index（n20）15175 ', '7 . Refractive indexn 20/D 15390(lit) ', '8 . Flash point（°F）125 ', '9 气相标准. Combustion heat(焓)(kJ·mol-1)-61405 ', '10 气相标准声称热(焓)( kJ·mol-1) -1890 ', '11 液相标准. Combustion heat(焓)(kJ·mol-1)-60773 ', '12 液相标准声称热(焓)( kJ·mol-1)-2522 ', '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 不能溶解的']
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