|
Vapor_Density:
|
4.8 (vs air)
|
|
MF:
|
C8H10O2
|
|
Water_Solubility:
|
0.8 g/l (20 ºC)
|
|
Bolling_Point:
|
212.6±0.0 °C at 760 mmHg
|
|
Exact_Mass:
|
138.068085
|
|
More_Info:
|
['一物性数据 ', '1. Appearance White 片状结晶，具丁香气味。 ', '2. Density（g/mL ,25/4℃）1053 ', '3. Flash point（℃）125 ', '4. Melting point（℃）58 ', '5. Boiling point（ºC）2126 ', '6. Boiling point（ºC,267kpa）109 ', '7. Solubility Soluble in Ethanol Ethyl ether and 苯，Insoluble in Water 。 ', '8 相对. Density（20℃，4℃）1038355']
|
|
Melting_Point:
|
54-56 °C(lit.)
|
|
PSA:
|
18.46000
|
|
Flash_Point:
|
73.5±19.4 °C
|
|
Refractive_Index:
|
1.488
|
|
Density:
|
1.0±0.1 g/cm3
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3960 ', '2 . Molar volume 1374 ', '3 . Parachor （902K）3206 ', '4 . Surface tension 296 ', '5 . Polarizability 1570']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 185 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :733 ', '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']
|
|
FW:
|
138.164
|
|
LogP:
|
2.10
|
|
Vapor_Pressure:
|
0.3±0.4 mmHg at 25°C
|
