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MF:
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C10H10
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Density:
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0.921g/cm3
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Computational_Chemistry:
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['1. XlogP :35 ', '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 :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :100 ', '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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More_Info:
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['1 . Appearance Colourless Liquid ', '2 . Density（g/mL,25℃）0914 ', '3 相对. Density（25℃，4℃）09240 ', '4 . Melting point（ºC）306 ', '5 . Boiling point（ºC）95 ', '6 . Boiling point（ºC,213kPa）86 ', '7 . Refractive index（n20/D） 15835 ', '8 . Flash point（ºF）148 ', '9 常温. Refractive index（n25）1582040 ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（hPa,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,20 ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（MPa）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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Exact_Mass:
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130.07800
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Vapor_Pressure:
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0.256mmHg at 25°C
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Flash_Point:
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75.1ºC
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Molecular_Structure:
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['1. Molar refractive index 481 ', '2. Molar volume 1413 ', '3. Parachor （902K）3372 ', '4. Surface tension 324 ', '5. Dielectric constant 233 ', '6. Polarizability 1906 ', '7. Single isotope mass 13007825 Da ', '8. Nominal mass 130 Da ', '9. Average mass 1301864 Da']
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LogP:
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2.97260
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Bolling_Point:
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212.1ºC at 760mmHg
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FW:
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130.18600
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Refractive_Index:
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n20/D 1.5470(lit.)
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