|
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 317738066 Da ', '8. Nominal mass 318 Da ', '9. Average mass 3192179 Da']
|
|
LogP:
|
1.76890
|
|
FW:
|
319.218
|
|
Density:
|
4.74
|
|
Bolling_Point:
|
624ºC
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :3 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :28 ', '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:
|
446ºC
|
|
MF:
|
I2Zn
|
|
More_Info:
|
['1 . Appearance White 无味的颗粒状Solid 。 ', '2 . Density（g/mL,25/4℃） 4736 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）446 ', '5 . Boiling point（ºC,Atmospheric pressure）625 ', '6 . Boiling point（ºC,52kPa） 无可用 ', '7 . Refractive index 无可用 ', '8 . Flash point（ºC） 625 ', '9 . Specific rotation（º） 无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC） 无可用 ', '11 . Vapor pressure（kPa,25ºC） 无可用 ', '12 . Saturated vapor pressure（kPa,60ºC） 无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC） 无可用 ', '15 . Critical pressure（KPa） 无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V） 无可用 ', '19 . Solubility Soluble in Water 甘油，在醇and Ethyl ether 中能无限溶解。']
|
|
Exact_Mass:
|
317.738068
|
