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Molecular_Structure:
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['五分子性质数据 ', '1 . Molar refractive index 5825 ', '2 . Molar volume 2095 ', '3 . Parachor （902K）5034 ', '4 . Surface tension 333 ', '5 . Polarizability 2309']
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Flash_Point:
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190 °F
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Refractive_Index:
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n20/D 1.4635(lit.)
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FW:
|
196.28600
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Density:
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0.983 g/mL at 25 °C(lit.)
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Bolling_Point:
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229-233 °C(lit.)
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Computational_Chemistry:
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['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count ', '6 . TPSA 263 ', '7 . Heavy Atom Count 14 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 270 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 3 ', '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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LogP:
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2.76430
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|
Melting_Point:
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29°C
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PSA:
|
26.30000
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|
MF:
|
C12H20O2
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More_Info:
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['1. Appearance Colourless Liquid ，与乙酸龙脑酯有同样的香气，并且更显清爽。 ', '2. Melting point29℃ ', '3. Boiling point220-224℃ ', '4相对. Density0978（20/4℃） ', '5折光率1463-1465 ', '6. Solubility Soluble in 三倍体积的70% Ethanol 中，与95% Ethanol ； Ethyl ether 混溶，Insoluble in Water and 甘油']
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Vapor_Pressure:
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0.0959mmHg at 25°C
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Exact_Mass:
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196.14600
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