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Molecular_Structure:
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['1 . Molar refractive index 8078 ', '2 . Molar volume 2424 ', '3 . Parachor （902K）6461 ', '4 . Surface tension 504 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 3202']
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LogP:
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1.53
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Flash_Point:
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213.7±28.7 °C
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Refractive_Index:
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1.581
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FW:
|
289.369
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Density:
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1.2±0.1 g/cm3
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Bolling_Point:
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429.8±45.0 °C at 760 mmHg
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Computational_Chemistry:
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['1 . XlogP 18 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 5 ', '5 . Isotope Atom Count ', '6 . TPSA 498 ', '7 . Heavy Atom Count 21 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 353 ', '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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Melting_Point:
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108.5ºC
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|
PSA:
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49.77000
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MF:
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C17H23NO3
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|
More_Info:
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['1 . Appearance White 结晶性粉末，无臭，苦辣味。易消旋，Water 溶液呈碱性。 ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）1085 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）21 ', '10 . Spontaneous ignition point or ignition temperature（ºC）: Unknow ', '11 . Vapor pressure（mmHg,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa, 25ºC）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 极易Soluble in Ethanol and 稀酸，易Soluble in 氯仿，可Soluble in Water Ethyl ether and 苯。']
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Vapor_Pressure:
|
0.0±1.1 mmHg at 25°C
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|
Exact_Mass:
|
289.167786
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