|
Refractive_Index:
|
1.596
|
|
Vapor_Pressure:
|
0.0±0.8 mmHg at 25°C
|
|
Flash_Point:
|
177.6±17.4 °C
|
|
LogP:
|
0.77
|
|
Bolling_Point:
|
346.6±17.0 °C at 760 mmHg
|
|
PSA:
|
57.53000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3924 ', '2 . Molar volume 1153 ', '3 . Parachor （902K）3206 ', '4 . Surface tension : 598 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1555']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 575 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :136 ', '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:
|
148-151 °C(lit.)
|
|
MF:
|
C8H8O3
|
|
Exact_Mass:
|
152.047348
|
|
FW:
|
152.147
|
|
Density:
|
1.3±0.1 g/cm3
|
|
More_Info:
|
['1. Appearance White 结晶粉末。 ', '2. Melting point（ºC）149-150 ', ' ', '3 . Solubility 微Soluble in Water ，Soluble in Ethyl ether Ethanol 乙酸乙酯。 ', '4 . Boiling point（ºC）3466 ', '5 . Flash point（ºC）1776 ', '6 相对. Density(d204) 1319']
|
