|
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 256055057 Da ', '8. Nominal mass 256 Da ', '9. Average mass 2561212 Da']
|
|
Flash_Point:
|
88.1ºC
|
|
FW:
|
256.121
|
|
Density:
|
1.254
|
|
Bolling_Point:
|
329ºC
|
|
Computational_Chemistry:
|
['1 . XlogP 21 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 5 ', '6 . TPSA 171 ', '7 . Heavy Atom Count 10 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 165 ', '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']
|
|
LogP:
|
2.77990
|
|
Melting_Point:
|
36-40ºC
|
|
PSA:
|
17.07000
|
|
MF:
|
C14H16FeO
|
|
More_Info:
|
['1 . Appearance 深橙色Liquid ', '2 . Density（g/mL,25℃）1254 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）37-40 ', '5 . Boiling point（ºC,Atmospheric pressure）329 ', '6 . Boiling point（ºC,25mmHg）Unknow ', '7 . Refractive index（n20/D）Unknow ', '8 . Flash point（ºF）>230 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '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 难溶解于Water 的']
|
|
Vapor_Pressure:
|
0.0758mmHg at 25°C
|
|
Exact_Mass:
|
256.055054
|
