|
Molecular_Structure:
|
['1 . Molar refractive index 6436 ', '2 . Molar volume 1897 ', '3 . Parachor （902K）5041 ', '4 . Surface tension 498 ', '5 . Polarizability 2551']
|
|
LogP:
|
3.16
|
|
Flash_Point:
|
212.7±29.3 °C
|
|
Refractive_Index:
|
1.594
|
|
FW:
|
228.051
|
|
Density:
|
1.2±0.1 g/cm3
|
|
Bolling_Point:
|
428.2±47.0 °C at 760 mmHg
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 497 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :217 ', '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:
|
125-130 °C(lit.)
|
|
PSA:
|
49.69000
|
|
MF:
|
C13H13BO3
|
|
More_Info:
|
['1 . Appearance White or Yellow Solid ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）122-124 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC 15mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）不适用的 ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt 36pt; TEXT-INDENT: -18pt; TEXT-ALIGN: left; mso-margin-top-alt: auto; mso-margin-bot']
|
|
Vapor_Pressure:
|
0.0±1.1 mmHg at 25°C
|
|
Exact_Mass:
|
228.095779
|
