|
Refractive_Index:
|
1.579
|
|
Vapor_Pressure:
|
0.0±0.9 mmHg at 25°C
|
|
Flash_Point:
|
196.0±24.6 °C
|
|
LogP:
|
1.82
|
|
Bolling_Point:
|
400.5±30.0 °C at 760 mmHg
|
|
PSA:
|
46.17000
|
|
Molecular_Structure:
|
['1. Molar refractive index 554 ', '2. Molar volume 1654 ', '3. Parachor （902K）4346 ', '4. Surface tension 476 ', '5. Dielectric constant N/A ', '6. Polarizability 2196 ', '7. Single isotope mass 211040006 Da ', '8. Nominal mass 211 Da ', '9. Average mass 2116449 Da']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :16 ', '6. TPSA 462 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :222 ', '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:
|
216-219 °C(lit.)
|
|
MF:
|
C10H10ClNO2
|
|
Exact_Mass:
|
211.040009
|
|
FW:
|
211.645
|
|
Density:
|
1.3±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance 无臭的橘Yellow or 褐色粉末 ', '2 . Density（g/mL,20℃）1348 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）215 ', '5 . Boiling point（ºC,Atmospheric pressure）393 ', '6 . Boiling point（ºC,04KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,20ºC）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 078 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Water （19 ºC）<01g/100ml']
|
