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More_Info:
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['1 . Appearance Colourless Liquid 2 . Density（g/mL,25/4℃） dl 0865 d 08733 l 08622 ', '3 相对. Density（20℃，4℃）08733 ', '4 常温. Refractive index(n20D) 14673 ', '5 . Boiling point（ºC,Atmospheric pressure）199 ', '6 . Boiling point（ºC,52kPa）dl 194～197℃（9599kPa）d 198～200℃l 198℃ ', '7 . Refractive indexd 14673，l 14604 ', '8 . Flash point（ºC）80 ', '9 . Specific rotation（º）[α]D20 d+193° l -201° ', '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 能与 Ethanol Ethyl ether 混溶，Insoluble in Water and 甘油。']
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Computational_Chemistry:
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['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :11 ', '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 :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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