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MF:
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C14H12
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Bolling_Point:
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312 °C(lit.)
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Exact_Mass:
|
180.09400
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More_Info:
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['一物性数据 ', '1 . Melting point（ºC）111ºC ', '2 . Boiling point（ºC,Atmospheric pressure）305ºC(lit) ', '3相对. Density(d204) 1215 ', '4 相对. Density（20℃，4℃）0897611 ', '5 气相标准. Combustion heat(焓)(kJ·mol-1)-73827 ', '6 气相标准声称热(焓)( kJ·mol-1) 1596 ', '7 液相标准. Combustion heat(焓)(kJ·mol-1)-730261 ', '8 液相标准声称热(焓)( kJ·mol-1)7850 ', '9 晶相相标准. Combustion heat(焓)(kJ·mol-1)-729042 ', '10晶相标准声称热(焓)( kJ·mol-1)6631 ', '11晶相标准熵(J·mol-1·K-1) 2294 ', '12晶相标准生成自由能( kJ·mol-1)25543']
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Melting_Point:
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103-107 °C(lit.)
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Flash_Point:
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131.8ºC
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Refractive_Index:
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1.62
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Density:
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0.88 g/mL at 25 °C(lit.)
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Molecular_Structure:
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['五分子性质数据 ', '1 . Molar refractive index 5840 ', '2 . Molar volume 1660 ', '3 . Parachor （902K）4268 ', '4 . Surface tension 436 ', '5 . Polarizability 2315']
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :154 ', '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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FW:
|
180.24500
|
|
LogP:
|
3.18160
|
