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Bolling_Point:
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243 °C(lit.)
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LogP:
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1.44620
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More_Info:
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['1 . Appearance 透明粘稠液 ', '2 . Density（g/mL,25/4℃）1064g/mL ', '3 . Relative vapor density（g/mL,Atmosphere =1）1463 ', '4 . Melting point（ºC）11 °C ', '5 . Boiling point（ºC,Atmospheric pressure）243°C ', '6 . Boiling point（ºC,28kPa）125-135℃ ', '7 . Refractive index15243-15245 ', '8 . Flash point（º F）>230°F ', '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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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 295 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :977 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '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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11 °C
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Vapor_Pressure:
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0.02mmHg at 25°C
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Exact_Mass:
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152.08400
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MF:
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C9H12O2
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Density:
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1.064 g/mL at 20 °C(lit.)
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Refractive_Index:
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n20/D 1.523(lit.)
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PSA:
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29.46000
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Flash_Point:
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>230 °F
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Molecular_Structure:
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['1 . Molar refractive index 4369 ', '2 . Molar volume （m3/mol）1443 ', '3 . Parachor （902K）3576 ', '4 . Surface tension 376 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1732']
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FW:
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152.19000
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