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Refractive_Index:
|
1.567
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Vapor_Pressure:
|
0.0±2.6 mmHg at 25°C
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Flash_Point:
|
412.2±32.9 °C
|
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LogP:
|
10.34
|
|
Bolling_Point:
|
757.9±60.0 °C at 760 mmHg
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|
PSA:
|
126.69000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 22839 ', '2 . Molar volume （m3/mol）6994 ', '3 . Parachor （902K）18309 ', '4 . Surface tension 469 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 9054']
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|
Computational_Chemistry:
|
['1. XlogP :128 ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :12 ', '5. Isotope Atom Count :4 ', '6. TPSA 122 ', '7. Heavy Atom Count :57 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :1170 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '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:
|
218-220 °C(lit.)
|
|
MF:
|
C48H69N3O6
|
|
Exact_Mass:
|
783.518616
|
|
FW:
|
784.078
|
|
Density:
|
1.1±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance White 结晶粉末 ', '2 . Density（g/mL,25/4℃）103 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）218-220 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）289 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 微Soluble in Water ，Soluble in 丙酮苯氯仿N，N-二甲基甲酰胺 Ethanol 甲醇。']
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