|
Refractive_Index:
|
1.623
|
|
Vapor_Pressure:
|
0.0±0.3 mmHg at 25°C
|
|
Flash_Point:
|
126.0±13.4 °C
|
|
LogP:
|
4.78
|
|
Bolling_Point:
|
300.0±11.0 °C at 760 mmHg
|
|
More_Info:
|
['1 . Appearance Colourless Solid ', '2 . Density0990 g/cm3 ', '3 晶相标准热熔(J·mol-1·K-1)226 ', '4 . Melting point（ºC）625 ', '5 . Boiling point（ºC,03 mmHg）90~97 ', '6 晶相相标准. Combustion heat(焓)(kJ·mol-1)-72507 ', '7 晶相标准声称热(焓)( kJ·mol-1)3124 ', '8 . Flash point（ºC）170 ', '9 . Specific rotation（º）Unknow ', '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 Soluble in Ethyl ether 热的 Ethanol 。']
|
|
Molecular_Structure:
|
['1 . Molar refractive index 5873 ', '2 . Molar volume 1666 ', '3 . Parachor （902K）4348 ', '4 . Surface tension 463 ', '5 . Polarizability 2328']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :193 ', '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:
|
59-61 °C(lit.)
|
|
MF:
|
C14H10
|
|
Exact_Mass:
|
178.078247
|
|
FW:
|
178.229
|
|
Density:
|
1.1±0.1 g/cm3
|
