|
Refractive_Index:
|
1.485
|
|
Vapor_Pressure:
|
0.00024mmHg at 25°C
|
|
Flash_Point:
|
230 °F
|
|
LogP:
|
3.74880
|
|
Bolling_Point:
|
80-90 °C0.25 mm Hg(lit.)
|
|
FW:
|
358.23800
|
|
PSA:
|
101.17000
|
|
Computational_Chemistry:
|
['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :12 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 101 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :526 ', '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:
|
40-42 °C(lit.)
|
|
MF:
|
C7H4F6N2O4S2
|
|
Exact_Mass:
|
357.95200
|
|
Molecular_Structure:
|
['1. Molar refractive index 5606 ', '2. Molar volume 1954 ', '3. Parachor （902K）517 ', '4. Surface tension 489 ', '5. Dielectric constant N/A ', '6. Polarizability 2222 ', '7. Single isotope mass 357951666 Da ', '8. Nominal mass 358 Da ', '9. Average mass 3582381 Da']
|
|
Density:
|
1.832 g/cm3
|
|
More_Info:
|
['1 . Appearance Yellow Solid ', '2 . Density（g/mL, 20 ℃ ） 1，13 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）40-42 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC 2mm ）97 ', '7 . Refractive index ', '8 . Flash point（ºC）110 ', '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 在Water 中发生Water 解']
|
