|
Molecular_Structure:
|
['1 . Molar refractive index 6292 ', '2 . Molar volume 2100 ', '3 . Parachor （902K）5229 ', '4 . Surface tension : 384 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 2494']
|
|
LogP:
|
3.51410
|
|
Flash_Point:
|
137.1ºC
|
|
FW:
|
215.35600
|
|
Density:
|
1.02 g/cm3
|
|
Bolling_Point:
|
303ºC at 760 mmHg
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 456 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :178 ', '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:
|
11.5ºC
|
|
PSA:
|
45.61000
|
|
MF:
|
C11H21NOS
|
|
More_Info:
|
['1 . Appearance 具有芳香气味的清亮Liquid 。 2 . Density（g/mL,25℃）0970 3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）145℃/1333×103Pa ', '6 . Boiling point（ºC,135mmHg）Unknow ', '7 . Refractive index（n20/D）n30D1054 ', '8 . Flash point（ºC）>100 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,25ºC）0266Pa ', '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 能Soluble in Water 的']
|
|
Exact_Mass:
|
215.13400
|
