|
Molecular_Structure:
|
['1. Molar refractive index N/A ', '2. Molar volume N/A ', '3. Parachor （902K）N/A ', '4. Surface tension N/A ', '5. Dielectric constant N/A ', '6. Polarizability N/A ', '7. Single isotope mass 78010894 Da ', '8. Nominal mass 780 Da ', '9. Average mass 780251 Da']
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|
Flash_Point:
|
181.7ºC
|
|
FW:
|
780.25100
|
|
Bolling_Point:
|
360ºC at 760 mmHg
|
|
Computational_Chemistry:
|
['1. XlogP ', '2. Hydrogen Bond Donor Count 0 ', '3. Hydrogen Bond Acceptor Count 2 ', '4. Rotatable Bond Count 6 ', '5. Isotope Atom Count ', '6. TPSA 1 ', '7. Heavy Atom Count 42 ', '8. Topological Polar Surface Area -1 ', '9. Complexity 214 ', '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 5']
|
|
LogP:
|
7.37110
|
|
Melting_Point:
|
215°C
|
|
PSA:
|
27.18000
|
|
MF:
|
C37H30ClIrOP2
|
|
More_Info:
|
['1 . Appearance 柠檬Yellow 结晶。在Atmosphere 中稳定。 ', '2 . Density（g/mL,25/4℃） Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC） 215 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '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。']
|
|
Vapor_Pressure:
|
4.74E-05mmHg at 25°C
|
|
Exact_Mass:
|
780.10900
|
