|
Refractive_Index:
|
1.576
|
|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
|
|
Flash_Point:
|
119.4±13.4 °C
|
|
LogP:
|
3.28
|
|
Bolling_Point:
|
304.0±11.0 °C at 760 mmHg
|
|
Water_Solubility:
|
Insoluble
|
|
PSA:
|
35.53000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 5921 ', '2 . Molar volume 1789 ', '3 . Parachor （902K）4610 ', '4 . Surface tension 440 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3）7 . Polarizability 2347']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 355 ', '7. Heavy Atom Count :16 ', '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']
|
|
Melting_Point:
|
79-82 °C(lit.)
|
|
MF:
|
C13H10O3
|
|
Exact_Mass:
|
214.062988
|
|
FW:
|
214.217
|
|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance White 结晶Solid 。 ', '2 . Density（g/mL,87/4℃）11215 ', '3 相对. Density（25℃，4℃）1121587 ', '4 . Melting point（ºC）83 ', '5 . Boiling point（ºC,Atmospheric pressure）306 ', '6 . Boiling point（ºC, kPa）Unknow ', '7 . Refractive index（20ºC）11550 ', '8 . Flash point（ºC）168 ', '9 气相标准. Combustion heat(焓)(kJ·mol-1)-62336 ', '10 气相标准声称热(焓)( kJ·mol-1) -3112 ', '11 液相标准. Combustion heat(焓)(kJ·mol-1)-61670 ', '12 液相标准声称热(焓)( kJ·mol-1)-3777 ', '13 晶相相标准. Combustion heat(焓)(kJ·mol-1)-61436 ', '14 晶相标准声称热(焓)( kJ·mol-1)-4012 ', '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 Insoluble in Water ，Soluble in 热 Ethanol 苯 Ethyl ether 四氯化碳冰醋酸等有机溶剂。']
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