|
Refractive_Index:
|
1.621
|
|
Vapor_Pressure:
|
0.0±0.7 mmHg at 25°C
|
|
Flash_Point:
|
142.3±20.1 °C
|
|
LogP:
|
3.46
|
|
Bolling_Point:
|
331.0±32.0 °C at 760 mmHg
|
|
FW:
|
208.255
|
|
PSA:
|
17.07000
|
|
Computational_Chemistry:
|
['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA 171 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :265 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
|
|
Melting_Point:
|
76-78ºC
|
|
MF:
|
C15H12O
|
|
Exact_Mass:
|
208.088821
|
|
Molecular_Structure:
|
['1 . Molar refractive index 6300 ', '2 . Molar volume （m3/mol）1792 ', '3 . Parachor （902K）4694 ', '4 . Surface tension 471 ', '5 . Polarizability 2497 ', '6 熔点: 75-78°C(lit) ', '7 沸点: 148°C07mm Hg(lit)']
|
|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
|
['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）75-78°C(lit)5. Boiling point（ºC,Atmospheric pressure）148°C07mm Hg(lit) ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexUnknow ', '8. Flash point（ºC）Unknow ', '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 Unknow']
|
