|
Refractive_Index:
|
1.427
|
|
Vapor_Pressure:
|
0.3±0.7 mmHg at 25°C
|
|
Flash_Point:
|
79.4±0.0 °C
|
|
LogP:
|
1.47
|
|
Bolling_Point:
|
187.3±8.0 °C at 760 mmHg
|
|
FW:
|
116.158
|
|
PSA:
|
37.30000
|
|
Computational_Chemistry:
|
['1. XlogP :15 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :947 ', '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:
|
-14°C
|
|
MF:
|
C6H12O2
|
|
Exact_Mass:
|
116.083733
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 3137 ', '2 . Molar volume 1222 ', '3 . Parachor （902K）2877 ', '4 . Surface tension 306 ', '5 . Polarizability 1243']
|
|
Density:
|
0.9±0.1 g/cm3
|
|
More_Info:
|
['物性数据 1 . Density（g/mL ,25/4℃）0928 ', '2 . Refractive index（nD20）14145 ', '3 . Flash point（°F）175°F ', '4 . Melting point（℃）186 ', '5 . Boiling point（ºC,067kpaor 5 mmHg）94-96°C ', '6 . Melting point（ºC）-14 ', '7 相对. Density（20℃，4℃）09276']
|
