Exact_Mass:
|
265.13100
|
MF:
|
C14H19NO4
|
Vapor_Pressure:
|
6.16E-06mmHg at 25°C
|
FW:
|
265.30500
|
More_Info:
|
['1 . Appearance Liquid ', '2 . Density(g/mL,20ºC)1082 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC)Unknow ', '6 . Boiling point(ºC,20mmHg)Unknow ', '7 . Refractive indexn 20/D 1511 ', '8 . Flash point(°F)Unknow ', '9 . Specific rotation(ºF)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,110ºC)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']
|
PSA:
|
72.12000
|
LogP:
|
4.38390
|
Molecular_Structure:
|
['1. Molar refractive index 7193 ', '2. Molar volume 2379 ', '3. Parachor (902K)6029 ', '4. Surface tension 412 ', '5. Dielectric constant N/A ', '6. Polarizability 2851 ', '7. Single isotope mass 265131408Da ', '8. Nominal mass 265Da ', '9. Average mass 265305Da']
|
Computational_Chemistry:
|
['1 . XlogP 45 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 8 ', '5 . Isotope Atom Count ', '6 . TPSA 694 ', '7 . Heavy Atom Count 19 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 280 ', '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']
|