|
Molecular_Structure:
|
['1. Molar refractive index 5944 ', '2. Molar volume 1758 ', '3. Parachor （902K）4505 ', '4. Surface tension 43 ', '5. Dielectric constant N/A ', '6. Polarizability 2356 ', '7. Single isotope mass 216058658 Da ', '8. Nominal mass 216 Da ', '9. Average mass 2162078 Da']
|
|
Flash_Point:
|
141.1±18.6 °C
|
|
Refractive_Index:
|
1.591
|
|
FW:
|
216.208
|
|
Density:
|
1.2±0.1 g/cm3
|
|
Bolling_Point:
|
317.6±27.0 °C at 760 mmHg
|
|
Computational_Chemistry:
|
['1. XlogP :3 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :216 ', '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:
|
4.13
|
|
Melting_Point:
|
77ºC
|
|
PSA:
|
26.30000
|
|
MF:
|
C13H9FO2
|
|
More_Info:
|
['1 . Appearance 粉末 ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）77 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）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 Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']
|
|
Vapor_Pressure:
|
0.0±0.7 mmHg at 25°C
|
|
Exact_Mass:
|
216.058655
|
![4,8-Dichloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-one(Loratadine Impurity) (CAS: 133330-60-6) - Related Chemical Product](/static/img/prod_pic/FT-0666570.png "4,8-Dichloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-one(Loratadine Impurity) chemical structure")
