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Molecular_Structure:
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['1 . Molar refractive index 23063 ', '2 . Molar volume 7017 ', '3 . Parachor （902K）18891 ', '4 . Surface tension 525 ', '5 . Polarizability 9143']
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Flash_Point:
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268.1±27.8 °C
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Refractive_Index:
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1.571
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FW:
|
873.077
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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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940.9±65.0 °C at 760 mmHg
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Computational_Chemistry:
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['1 . XlogP ', '2 . Hydrogen Bond Donor Count 6 ', '3 . Hydrogen Bond Acceptor Count 28 ', '4 . Rotatable Bond Count 15 ', '5 . TPSA 340 ', '6 . Heavy Atom Count 123 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 3430 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
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LogP:
|
6.51
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|
Melting_Point:
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150-155°C
|
|
PSA:
|
170.06000
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MF:
|
C48H72O14
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|
More_Info:
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['1 . Appearance 原药B1a为White 无臭结晶粉末 2 . Density（g/mL,25/4℃）116 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow 4 . Melting point（ºC）153～157℃ 5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）＞150 9 . Specific rotation（º）［α］27D为+553° 10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）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 可Soluble in 一般有机溶剂，几乎Insoluble in Water ，易被酸碱Water 解']
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|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
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|
Exact_Mass:
|
872.492188
|
