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Molecular_Structure:
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['1 . Molar refractive index 5921 ', '2 . Molar volume 2169 ', '3 . Parachor （902K）5010 ', '4 . Surface tension 284 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 2347']
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Flash_Point:
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98.9±0.0 °C
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|
Refractive_Index:
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1.458
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FW:
|
196.286
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Density:
|
0.9±0.1 g/cm3
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|
Bolling_Point:
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247.5±0.0 °C at 760 mmHg
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|
Melting_Point:
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< 25ºC
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|
Computational_Chemistry:
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['1. XlogP :35 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :233 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :1 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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|
LogP:
|
4.10
|
|
Vapor_Density:
|
6.8 (vs air)
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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 to 淡Yellow 油状Liquid ', '2 . Density（g/mL,25℃）092 ', '3 . Boiling point（ºC）13825 ', '4 . Boiling point（ºC, 29kPa）130-132 ', '5 . Refractive index（n/20D)14655 ', '6 . Flash point（ºC）104 ', '7 . Solubility 易Soluble in Ethanol 丙酮乙酸乙酯等有机溶剂，微Soluble in 丙二醇，Insoluble in Water and 甘油。 ', '8 常温. Refractive index（n25）14600 ', '9 相对. Density（20℃，4℃）0916015']
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Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
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|
Exact_Mass:
|
196.146332
|
