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MF:
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C10H22O
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Bolling_Point:
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211 °C(lit.)
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Exact_Mass:
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158.16700
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More_Info:
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['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,25℃）0827 ', '3 相对. Density（20℃，4℃）08254 ', '4 . Melting point（ºC）-2 ', '5 . Boiling point（ºC,Atmospheric pressure）2097 ', '6 相对. Density（25℃，4℃）08216 ', '7 . Refractive index(n 20/D) 1434 ', '8 . Flash point（ºC）85 ', '9 常温. Refractive index（n25）1432 ', '10 . Spontaneous ignition point or ignition temperature（ºC）85 11 . Vapor pressure（mmHg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Critical temperature（ºC）49545 ', '14 . Critical pressure（MPa）2315 ', '15 临界. Density（g·cm-3）0245 ', '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 不能拌and 的or 难以拌and 的']
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Melting_Point:
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−6-−4 °C(lit.)
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PSA:
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20.23000
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Flash_Point:
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185 °F
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Refractive_Index:
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n20/D 1.434(lit.)
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Density:
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0.827 g/mL at 25 °C(lit.)
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Molecular_Structure:
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['1 . Molar refractive index 4867 ', '2 . Molar volume 1914 ', '3 . Parachor （902K）4441 ', '4 . Surface tension 289 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1977']
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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 :1 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :713 ', '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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FW:
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158.28100
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LogP:
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3.11780
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Vapor_Pressure:
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0.0393mmHg at 25°C
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