|
Refractive_Index:
|
1.592
|
|
Vapor_Pressure:
|
1.1±0.3 mmHg at 25°C
|
|
Flash_Point:
|
67.2±0.0 °C
|
|
LogP:
|
3.31
|
|
Bolling_Point:
|
183.0±13.0 °C at 760 mmHg
|
|
More_Info:
|
['1 . Appearance Colourless or Yellow Liquid ', '2 . Density（g/mL,25℃）189 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-42 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,19mmHg）77-78 ', '7 . Refractive index(n20/D)1584 8 . Flash point（ºC）67 9 . Specific rotation（ º ） Unknow 10 . Spontaneous ignition point or ignition temperature（ ºC ）67 11 . Vapor pressure（ mmHg,20ºC ） 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 Ethanol Ethyl ether ，Insoluble in Water 。']
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3915 ', '2 . Molar volume （m3/mol）1157 ', '3 . Parachor （902K）2900 ', '4 . Surface tension :394 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 1552']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :749 ', '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:
|
-42°C
|
|
MF:
|
C6H4FI
|
|
Exact_Mass:
|
221.934158
|
|
FW:
|
221.999
|
|
Density:
|
1.9±0.1 g/cm3
|
