|
Refractive_Index:
|
1.421
|
|
Vapor_Pressure:
|
0.8±0.6 mmHg at 25°C
|
|
Flash_Point:
|
61.8±6.5 °C
|
|
LogP:
|
2.29
|
|
Bolling_Point:
|
161.3±8.0 °C at 760 mmHg
|
|
FW:
|
116.201
|
|
PSA:
|
20.23000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :377 ', '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:
|
-41.5 °C
|
|
MF:
|
C7H16O
|
|
Exact_Mass:
|
116.120117
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 3597 ', '2 . Molar volume 1419 ', '3 . Parachor （902K）3247 ', '4 . Surface tension 273 ', '5 . Polarizability 1426']
|
|
Density:
|
0.8±0.1 g/cm3
|
|
More_Info:
|
['一物性数据 ', '1 . Melting point（ºC）-42 ', '2 . Boiling point（ºC,Atmospheric pressure）1550°C ', '3 . Density081g/mLat 25°C(lit ', '4 . Refractive indexn20/D 14200(lit) ', '5 . Flash point（ºC）48 ', '6 相对. Density（20℃，4℃）08187 ', '7 相对. Density（25℃，4℃）08149 ', '8 常温. Refractive index（n25）1418 ', '9 . Critical temperature（ºC）32945 ', '10 临界. Density（g·cm-3）02689 ', '11 临界体积（cm3·mol-1）432']
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