|
Molecular_Structure:
|
['1 . Molar refractive index 5710 ', '2 . Molar volume 2254 ', '3 . Parachor （902K）5283 ', '4 . Surface tension 301 ', '5 . Polarizability 2263']
|
|
Flash_Point:
|
140.6±0.0 °C
|
|
Refractive_Index:
|
1.421
|
|
FW:
|
222.279
|
|
Density:
|
1.0±0.1 g/cm3
|
|
Water_Solubility:
|
可溶
|
|
Bolling_Point:
|
275.3±0.0 °C at 760 mmHg
|
|
Melting_Point:
|
−30 °C(lit.)
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :12 ', '5. Isotope Atom Count :N/A ', '6. TPSA 462 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :98 ', '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:
|
-1.51
|
|
Vapor_Density:
|
7.7 (vs air)
|
|
PSA:
|
46.15000
|
|
MF:
|
C10H22O5
|
|
More_Info:
|
['1 . Appearance Colourless 透明Liquid 。 ', '2 . Boiling point（ºC,1013kPa）2753 ', '3 . Melting point（ºC）-297 ', '4 相对. Density（g/mL,20/4ºC）10087 ', '5相对. Density（25℃，4℃）09912414 ', '6 . Refractive index（20ºC）14325 ', '7 . Flash point（ºC）140 ', '8 . Solubility 能与Water 及各种有机溶剂混溶。 ', '9溶度参数(J·cm-3)0518067 ', '10van der Waals面积（cm2·mol-1）1804×1010 ', '11van der Waals体积（cm3·mol-1）127680 ', '12液相标准热熔(J·mol-1·K-1)4007']
|
|
Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
|
|
Exact_Mass:
|
222.146729
|
