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MF:
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C11H18O
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Bolling_Point:
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120-121 °C12 mm Hg(lit.)
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Exact_Mass:
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166.13600
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More_Info:
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['1 . Appearance 浅Yellow 油状Liquid ', '2 . Density（g/mL,25℃）0916 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,12mmHg）120-121 ', '7 . Refractive index（n20/D）1479 ', '8 . Flash point（ºF）230 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）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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PSA:
|
17.07000
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Flash_Point:
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230 °F
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Computational_Chemistry:
|
['1. XlogP :29 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :10 ', '6. TPSA 171 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :201 ', '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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Density:
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0.916 g/mL at 25 °C(lit.)
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Molecular_Structure:
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['1 . Molar refractive index 5071 ', '2 . Molar volume （m3/mol）1815 ', '3 . Parachor （902K）4263 ', '4 . Surface tension : 303 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 2010']
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Vapor_Pressure:
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0.0575mmHg at 25°C
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|
FW:
|
166.26000
|
|
LogP:
|
3.24610
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|
Refractive_Index:
|
n20/D 1.479(lit.)
|
